SCHEMBL19601252

SCHEMBL19601252

CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CC2C=CC1C2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49
NPC1 O15118 1/20 0.43
NFKB1 P19838 1/20 0.43
RAB9A P51151 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
EPHX1 P07099 1/20 0.43
FPR3 P25089 4/20 0.41
FPR2 P25090 4/20 0.41
TDP1 Q9NUW8 1/20 0.40
ESR1 P03372 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
TLR2 O60603 1/20 0.38
TLR1 Q15399 1/20 0.38
ALDH1A1 P00352 2/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL9924681 1.00 KDM4E (0.49) KDM4ELMNANPC1NFKB1RAB9A
SCHEMBL26031407 0.94 TDP1 (0.50) KDM4ELMNANPC1NFKB1RAB9A
SCHEMBL19186278 0.94 TDP1 (0.50) KDM4ELMNANPC1NFKB1RAB9A
SCHEMBL13107792 0.83 KDM4E (0.41) KDM4ELMNANPC1NFKB1RAB9A
SCHEMBL9925978 0.79 KDM4E (0.42) KDM4ELMNANPC1NFKB1RAB9A
SCHEMBL10124090 0.78 KDM4E (0.59) KDM4ELMNANPC1NFKB1RAB9A
SCHEMBL14392991 0.78 KDM4E (0.59) KDM4ELMNANPC1NFKB1RAB9A
SCHEMBL11064769 0.76 KDM4E (0.61) KDM4ELMNANPC1NFKB1RAB9A
SCHEMBL11064771 0.76 KDM4E (0.61) KDM4ELMNANPC1NFKB1RAB9A
SCHEMBL19822715 0.76 EPHX1 (0.37) KDM4ELMNANFKB1NFKB2RELA

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210301078-A1 COMPOSITIONS AND METHODS OF MAKING POLYMERIZING NUCLEIC ACIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-09-30 US disclosed
US-20210283054-A1 HIGH DENSITY PEPTIDE POLYMERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-09-16 US disclosed
US-11072681-B2 Compositions and methods of making polymerizing nucleic acids THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-07-27 US disclosed
US-10980744-B2 High density peptide polymers THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-04-20 US disclosed
US-20180169275-A1 POLYMERIC MICELLAR NANOPARTICLES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-06-21 US disclosed
US-20180169275-A1 POLYMERIC MICELLAR NANOPARTICLES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-06-21 US disclosed
US-20180042843-A1 HIGH DENSITY PEPTIDE POLYMERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-02-15 US disclosed
US-20180042843-A1 HIGH DENSITY PEPTIDE POLYMERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-02-15 US disclosed
US-20170327633-A1 COMPOSITIONS AND METHODS OF MAKING POLYMERIZING NUCLEIC ACIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-11-16 US disclosed
US-20170327633-A1 COMPOSITIONS AND METHODS OF MAKING POLYMERIZING NUCLEIC ACIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-11-16 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 (7 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-20180169275-A1 POLYMERIC MICELLAR NANOPARTICLES PHOSPHO1, LIPA, PITPNB KDM4E 4470/4885LMNA 329/4885NPC1 55/4885
US-11072681-B2 Compositions and methods of making polymerizing nucleic acids RNGTT, NSUN2, POLN KDM4E 4223/4885LMNA 79/4885NPC1 1860/4885
US-20180042843-A1 HIGH DENSITY PEPTIDE POLYMERS ERMP1, PARL, PRAP1 KDM4E 4561/4885LMNA 2706/4885NPC1 1559/4885
US-10980744-B2 High density peptide polymers IAPP, LCP1, LNPEP KDM4E 4666/4885LMNA 2117/4885NPC1 3281/4885
US-20170327633-A1 COMPOSITIONS AND METHODS OF MAKING POLYMERIZING NUCLEIC ACIDS RNGTT, NSUN2, POLN KDM4E 4223/4885LMNA 79/4885NPC1 1860/4885
US-20210301078-A1 COMPOSITIONS AND METHODS OF MAKING POLYMERIZING NUCLEIC ACIDS RNGTT, NSUN2, POLN KDM4E 4223/4885LMNA 79/4885NPC1 1860/4885
US-20210283054-A1 HIGH DENSITY PEPTIDE POLYMERS IAPP, LCP1, LNPEP KDM4E 4666/4885LMNA 2117/4885NPC1 3281/4885

“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.