SCHEMBL3864466

SCHEMBL3864466

CC(NC(=O)CBr)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPT P10636 1/20 0.44
FAAH O00519 3/20 0.43
MME P08473 3/20 0.42
ACE P12821 1/20 0.42
CPA1 P15085 1/20 0.42
ACE2 Q9BYF1 1/20 0.42
HSD17B10 Q99714 1/20 0.41
TSHR P16473 2/20 0.41
SLC6A5 Q9Y345 1/20 0.41
RAB9A P51151 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ASAH1 Q13510 1/20 0.36
LTA4H P09960 1/20 0.36
ANPEP P15144 1/20 0.36
ECE1 P42892 1/20 0.36

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
SCHEMBL6954452 1.00 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1KDM4EMAPTFAAH
SCHEMBL30628732 1.00 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1KDM4EMAPTFAAH
SCHEMBL20268790 0.92 MME (0.46) SMN1; SMN2ALDH1A1KDM4EMAPTFAAH
SCHEMBL20268787 0.92 MME (0.46) SMN1; SMN2ALDH1A1KDM4EMAPTFAAH
SCHEMBL20268789 0.92 MME (0.46) SMN1; SMN2ALDH1A1KDM4EMAPTFAAH
SCHEMBL4189346 0.78 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1KDM4EMAPTFAAH
SCHEMBL4811735 0.78 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1KDM4EMAPTFAAH
SCHEMBL6309640 0.78 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1KDM4EMAPTFAAH
SCHEMBL4811341 0.78 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1KDM4EMAPTFAAH
SCHEMBL10076082 0.78 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1KDM4EMAPTFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240091315-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME AMUNIX PHARMACEUTICALS, INC. 2024-03-21 US disclosed
US-11725222-B2 Cleavable nucleotide analogs and uses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-08-15 US disclosed
US-20210322518-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME AMUNIX PHARMACEUTICALS, INC. 2021-10-21 US disclosed
US-10953073-B2 XTEN conjugate compositions and methods of making same AMUNIX PHARMACEUTICALS, INC. (US) 2021-03-23 US disclosed
WO-2020243047-A1 CONTROLLED HEAT DELIVERY COMPOSITIONS BAMBU VAULT LLC (US) 2020-12-03 WO disclosed
US-20200080122-A1 Cleavable Nucleotide Analogs and Uses Thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2020-03-12 US disclosed
WO-2020037177-A1 SELF-HEALING, OMNIPHOBIC COATINGS AND RELATED METHODS UNIVERSITY OF KANSAS (US) 2020-02-20 WO disclosed
US-20190083577-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME AMUNIX PHARMACEUTICALS, INC. 2019-03-21 US disclosed
US-10172953-B2 XTEN conjugate compositions and methods of making same AMUNIX OPERATING INC. (US) 2019-01-08 US disclosed
US-10163648-B2 Method of semiconductor device fabrication having application of material with cross-linkable component TAIWAN SEMICONDUCTOR MANUFACTURING CO., LTD. (TW) 2018-12-25 US disclosed
WO-2016146261-A1 COMBINATION OF AN IMMUNE CHECKPOINT MODULATOR AND A COMPLEX COMPRISING A CELL PENETRATING PEPTIDE, A CARGO AND A TLR PEPTIDE AGONIST FOR USE IN MEDICINE AMAL THERAPEUTICS SA (CH) 2016-09-22 WO disclosed
WO-2016146262-A1 A NOVEL COMPLEX COMPRISING A CELL PENETRATING PEPTIDE, A CARGO AND A TLR PEPTIDE AGONIST FOR TREATMENT OF COLORECTAL CANCER AMAL THERAPEUTICS SA (CH) 2016-09-22 WO disclosed
WO-2016146260-A1 A NOVEL COMPLEX COMPRISING A CELL PENETRATING PEPTIDE, A CARGO AND A TLR PEPTIDE AGONIST AMAL THERAPEUTICS SA (CH) 2016-09-22 WO disclosed
EP-2890703-A1 SYNTHESIS OF DIVERSE GLYCOSYLPHOSPHATIDYLINOSITOL GLYCANS FROM TOXOPLASMA GONDII AND THEIR APPLICATION AS VACCINES AND DIAGNOSTICS Max-Planck-Gesellschaft zur Förderung der Wissenschaften (DE) 2015-07-08 EP disclosed
US-20150037359-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME Amunix Operating, Inc. (US) 2015-02-05 US disclosed
WO-2014016317-A1 SYNTHESIS OF DIVERSE GLYCOSYLPHOSPHATIDYLINOSITOL GLYCANS FROM TOXOPLASMA GONDII AND THEIR APPLICATION AS VACCINES AND DIAGNOSTICS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2014-01-30 WO disclosed
US-7595198-B2 Photocleavable isotope-coded affinity tags AMBERGEN, INC. (US) 2009-09-29 US disclosed
US-20080032417-A1 Photocleavable isotope-coded affinity tags AMBERGEN, INC 2008-02-07 US disclosed
US-7145019-B2 Photocleavable isotope-coded affinity tags AMBERGEN, INC. (US) 2006-12-05 US disclosed
US-20050085630-A1 Photocleavable isotope-coded affinity tags AMBERGEN INC. 2005-04-21 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 (10 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-20150037359-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME XPA, TXLNA, NGLY1 SMN1; SMN2 1489/4885ALDH1A1 3685/4885KDM4E 2338/4885
US-10172953-B2 XTEN conjugate compositions and methods of making same XPA, TXLNA, NGLY1 SMN1; SMN2 1489/4885ALDH1A1 3685/4885KDM4E 2338/4885
US-20210322518-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME XPA, TXLNA, NGLY1 SMN1; SMN2 1489/4885ALDH1A1 3685/4885KDM4E 2338/4885
US-10953073-B2 XTEN conjugate compositions and methods of making same XPA, TXLNA, NGLY1 SMN1; SMN2 1489/4885ALDH1A1 3685/4885KDM4E 2338/4885
US-20050085630-A1 Photocleavable isotope-coded affinity tags PTMS, DNPEP, ACP1 SMN1; SMN2 4487/4885ALDH1A1 1588/4885KDM4E 2457/4885
US-20190083577-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME XPA, TXLNA, NGLY1 SMN1; SMN2 1489/4885ALDH1A1 3685/4885KDM4E 2338/4885
US-20200080122-A1 Cleavable Nucleotide Analogs and Uses Thereof TYMP, DUT, NT5C3B SMN1; SMN2 2082/4885ALDH1A1 3387/4885KDM4E 3510/4885
US-11725222-B2 Cleavable nucleotide analogs and uses thereof TYMP, DUT, NT5C3B SMN1; SMN2 2082/4885ALDH1A1 3387/4885KDM4E 3510/4885
US-20240091315-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME XPA, TXLNA, NGLY1 SMN1; SMN2 1489/4885ALDH1A1 3685/4885KDM4E 2338/4885
US-20080032417-A1 Photocleavable isotope-coded affinity tags PTMS, DNPEP, ACP1 SMN1; SMN2 4487/4885ALDH1A1 1588/4885KDM4E 2457/4885

“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.