SCHEMBL14873283

SCHEMBL14873283

CNC(=O)CC(=O)NC1CCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.52
NPSR1 Q6W5P4 1/20 0.50
EPHX1 P07099 6/20 0.48
HPGD P15428 2/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 2/20 0.47
HDAC3 O15379 2/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC10 Q969S8 2/20 0.44
HDAC11 Q96DB2 2/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
NCOR2 Q9Y618 1/20 0.44
LMNA P02545 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MAPT P10636 1/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP3A4 P08684 1/20 0.43

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
SCHEMBL14873215 0.94 NPSR1 (0.58) SMN1; SMN2NPSR1EPHX1HPGDKMT2A
SCHEMBL14873284 0.91 SMN1; SMN2 (0.45) SMN1; SMN2NPSR1EPHX1HPGDKMT2A
SCHEMBL14873229 0.82 EPHX1 (0.55) SMN1; SMN2NPSR1EPHX1HPGDKMT2A
SCHEMBL3075216 0.81 EPHX1 (0.68) SMN1; SMN2NPSR1EPHX1HPGDKMT2A
SCHEMBL16103854 0.80 SIGMAR1 (0.46) EPHX1ALDH1A1LMNAKDM4E
SCHEMBL2416229 0.80 SMN1; SMN2 (0.54) SMN1; SMN2NPSR1EPHX1HPGDKMT2A
SCHEMBL12806858 0.79 SMN1; SMN2 (0.48) SMN1; SMN2NPSR1EPHX1HPGDKMT2A
SCHEMBL12829197 0.78 SMN1; SMN2 (0.47) SMN1; SMN2NPSR1EPHX1HPGDKMT2A
SCHEMBL16786337 0.77 ALDH1A1 (0.61) SMN1; SMN2NPSR1EPHX1HPGDKMT2A
SCHEMBL256674 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8906852-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2014-12-09 US disclosed
US-20140315801-A1 METHODS OF TREATMENT OF CELL PROLIFERATIVE AND/OR OPHTHALMIC DISEASES, DISORDERS AND CONDITIONS USING INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC (CA) 2014-10-23 US disclosed
US-20140179632-A1 METHODS OF INHIBITING PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2014-06-26 US disclosed
US-8759522-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2014-06-24 US disclosed
US-8729268-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2014-05-20 US disclosed
US-20130096088-A1 Inhibitors of Protein Tyrosine Kinase Activity METHYLGENE INC. (CA) 2013-04-18 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 (3 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-20140179632-A1 METHODS OF INHIBITING PROTEIN TYROSINE KINASE ACTIVITY PTK2B, PRKACA, DSTYK SMN1; SMN2 3148/4885NPSR1 2842/4885EPHX1 2168/4885
US-20130096088-A1 Inhibitors of Protein Tyrosine Kinase Activity KDR, FLT1, FLT4 SMN1; SMN2 2304/4885NPSR1 2202/4885EPHX1 3059/4885
US-20140315801-A1 METHODS OF TREATMENT OF CELL PROLIFERATIVE AND/OR OPHTHALMIC DISEASES, DISORDERS AND CONDITIONS USING INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY FLT1, KDR, FLT4 SMN1; SMN2 3561/4885NPSR1 1491/4885EPHX1 1966/4885

“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.