SCHEMBL13635958

SCHEMBL13635958

CC(C)(C)Cc1ccc(NC(C)(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.52
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
HPGD P15428 3/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
LMNA P02545 2/20 0.34
SLC6A2 P23975 2/20 0.34
HTR2A P28223 1/20 0.34
SLC6A4 P31645 1/20 0.34
HRH1 P35367 1/20 0.34
HTR2B P41595 1/20 0.34
CHRNA4 P43681 1/20 0.34
SLC6A3 Q01959 1/20 0.34
CYP2D6 P10635 1/20 0.34
ESR2 Q92731 3/20 0.34
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
GHSR Q92847 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6248799 0.81 HPGD (0.45) HPGDNPC1RAB9ALMNASMN1; SMN2
SCHEMBL13884337 0.81 LMNA (0.48) ESR1HPGDLMNAESR2HTT
SCHEMBL16240889 0.81 ESR1 (0.56) ESR1THRATHRBHPGDNPC1
SCHEMBL14670707 0.80 ESR1 (0.50) ESR1THRATHRBHPGDNPC1
SCHEMBL6685103 0.80 ESR1 (0.74) ESR1THRATHRBLMNASLC6A2
SCHEMBL4603900 0.80 IDO1 (0.39) THRBHPGDNPC1RAB9ALMNA
SCHEMBL21298845 0.79 ESR1 (0.41) ESR1THRATHRBHPGDNPC1
SCHEMBL13233319 0.79 ESR1 (0.54) ESR1THRATHRBHPGDLMNA
SCHEMBL19295451 0.78 NPC1 (0.40) HPGDNPC1RAB9ASLC6A2
SCHEMBL18812301 0.78 ESR1 (0.44) ESR1THRATHRB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12036286-B2 Selective drug release from internalized conjugates of biologically active compounds SEAGEN INC. (US) 2024-07-16 US disclosed
US-12019371-B2 Photosensitive composition, film, color filter, solid-state imaging element, and image display device FUJIFILM CORPORATION (JP) 2024-06-25 US disclosed
US-20240067640-A1 PHENYL MALEIMIDE LINKER AGENTS FIREFLY BIO, INC. 2024-02-29 US disclosed
US-20240067640-A1 PHENYL MALEIMIDE LINKER AGENTS FIREFLY BIO, INC. 2024-02-29 US disclosed
EP-3407916-B1 PHOSPHONATE LINKERS AND THEIR USE TO FACILITATE CELLULAR RETENTION OF COMPOUNDS MERCK SHARP & DOHME LLC (US) 2023-12-20 EP disclosed
US-20230357180-A1 DEGRADERS AND DEGRONS FOR TARGETED PROTEIN DEGRADATION C4 THERAPEUTICS, INC. (US) 2023-11-09 US disclosed
US-11779649-B2 Antibodies to PMEL17 and conjugates thereof NOVARTIS AG (CH) 2023-10-10 US disclosed
US-11779649-B2 Antibodies to PMEL17 and conjugates thereof NOVARTIS AG (CH) 2023-10-10 US disclosed
US-20230279023-A1 N/O-Linked Degrons and Degronimers for Protein Degradation C4 THERAPEUTICS, INC. (US) 2023-09-07 US disclosed
US-11730817-B2 Pro-cyclic dinucleotides and pro-cyclic dinucleotide conjugates for cytokine induction INVIVOGEN (FR) 2023-08-22 US disclosed
US-20170355731-A1 AMATOXIN DERIVATIVES AND CONJUGATES THEREOF AS INHIBITORS OF RNA POLYMERASE NOVARTIS INSTITUTE FOR FUNCTIONAL GENOMICS, INC., DBA GENOMICS INSTITUTE OF THE NOVARTIS RESEARCH FOUNDATION 2017-12-14 US disclosed
US-20170121282-A1 AURISTATIN DERIVATIVES AND CONJUGATES THEREOF NOVARTIS AG (CH) 2017-05-04 US disclosed
US-20170121282-A1 AURISTATIN DERIVATIVES AND CONJUGATES THEREOF NOVARTIS AG (CH) 2017-05-04 US disclosed
US-20160311853-A1 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF NOVARTIS AG (CH) 2016-10-27 US disclosed
US-20140065075-A1 TARGETED CONTRAST AGENTS AND USES THEREOF RF THERAPEUTICS INC. (CA) 2014-03-06 US disclosed
US-8562953-B2 Dendritic polymers and magnetic resonance imaging contrast agent employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-10-22 US disclosed
US-20130030139-A1 DENDRITIC POLYMERS AND MAGNETIC RESONANCE IMAGING CONTRAST AGENT EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-01-31 US disclosed
US-8303937-B2 Dendritic polymers and magnetic resonance imaging contrast agent employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-11-06 US disclosed
US-20090169480-A1 DENDRITIC POLYMERS AND MAGNETIC RESONANCE IMAGING CONTRAST AGENT EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2009-07-02 US disclosed
US-20090169481-A1 DENDRITIC POLYMERS AND MAGNETIC RESONANCE IMAGING CONTRAST AGENT EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2009-07-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11779649-B2 Antibodies to PMEL17 and conjugates thereof GNA15, GNA11, EEA1 ESR1 3287/4885THRA 3239/4885THRB 3721/4885
US-20090169481-A1 DENDRITIC POLYMERS AND MAGNETIC RESONANCE IMAGING CONTRAST AGENT EMPLOYING THE SAME DCLK1, MSR1, S1PR3 ESR1 3624/4885THRA 4502/4885THRB 4650/4885
US-11730817-B2 Pro-cyclic dinucleotides and pro-cyclic dinucleotide conjugates for cytokine induction STING1, CGAS, TLR9 ESR1 3545/4885THRA 3687/4885THRB 3397/4885
US-20170355731-A1 AMATOXIN DERIVATIVES AND CONJUGATES THEREOF AS INHIBITORS OF RNA POLYMERASE RNGTT, RNASE1, RNMT ESR1 4726/4885THRA 3163/4885THRB 2762/4885
US-20160311853-A1 CYTOTOXIC PEPTIDES AND CONJUGATES THEREOF CD47, NGLY1, VIP ESR1 3967/4885THRA 3963/4885THRB 3616/4885
US-20230357180-A1 DEGRADERS AND DEGRONS FOR TARGETED PROTEIN DEGRADATION STUB1, MDM2, USP30 ESR1 1132/4885THRA 2185/4885THRB 2605/4885
US-20170121282-A1 AURISTATIN DERIVATIVES AND CONJUGATES THEREOF AURKC, AURKA, AURKB ESR1 2968/4885THRA 3267/4885THRB 3102/4885
US-20140065075-A1 TARGETED CONTRAST AGENTS AND USES THEREOF ANTXR2, CALCOCO2, PAICS ESR1 4117/4885THRA 2600/4885THRB 3564/4885
US-20090169480-A1 DENDRITIC POLYMERS AND MAGNETIC RESONANCE IMAGING CONTRAST AGENT EMPLOYING THE SAME CD14, DCUN1D3, CCR3 ESR1 3929/4885THRA 3177/4885THRB 4028/4885
US-20240067640-A1 PHENYL MALEIMIDE LINKER AGENTS TPX2, H1-4, MAPT ESR1 1807/4885THRA 531/4885THRB 251/4885
US-20230279023-A1 N/O-Linked Degrons and Degronimers for Protein Degradation CRBN, CBL, STUB1 ESR1 1237/4885THRA 952/4885THRB 703/4885
US-12036286-B2 Selective drug release from internalized conjugates of biologically active compounds CTSB, CTSE, CTSZ ESR1 2105/4885THRA 2773/4885THRB 1313/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.