SCHEMBL13734971

SCHEMBL13734971

CC(O)c1cccc(NC(=O)O)c1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.75
KMT2A Q03164 2/20 0.75
KDM4E B2RXH2 1/20 0.61
LMNA P02545 3/20 0.60
EGFR P00533 1/20 0.55
PIK3CA P42336 1/20 0.55
HSD11B1 P28845 1/20 0.51
MTOR P42345 1/20 0.47
FADS1 O60427 1/20 0.47
TSHR P16473 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 2/20 0.45
CA2 P00918 1/20 0.44

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
SCHEMBL4099226 1.00 MEN1 (0.75) MEN1KMT2AKDM4ELMNAEGFR
SCHEMBL25439873 1.00 MEN1 (0.75) MEN1KMT2AKDM4ELMNAEGFR
SCHEMBL2096086 0.87 FADS1 (0.59) MEN1KMT2AKDM4ELMNAMTOR
SCHEMBL28632640 0.84 LMNA (0.54) MEN1KMT2AKDM4ELMNAMTOR
SCHEMBL13735092 0.84 MEN1 (0.54) MEN1KMT2AKDM4ELMNAMTOR
SCHEMBL3719163 0.84 MEN1 (0.54) MEN1KMT2AKDM4ELMNAMTOR
SCHEMBL24166526 0.84 MEN1 (0.73) MEN1KMT2AKDM4ELMNAEGFR
SCHEMBL15652254 0.84 MEN1 (0.53) MEN1KMT2AKDM4ELMNAMTOR
SCHEMBL24166613 0.83 MEN1 (0.81) MEN1KMT2AKDM4ELMNAEGFR
SCHEMBL7356216 0.82 MEN1 (0.53) MEN1KMT2AKDM4ELMNAMTOR

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-11767296-B2 Heteroaryl compounds as kinase inhibitor FUJIAN HAIXI PHARMACEUTICALS CO., LTD (CN) 2023-09-26 US disclosed
CN-104860890-A T790M mutant epidermal growth factor receptor (EGFR) inhibitor and application of same in preparation of antitumor drugs PHARMARESOURCES SHANGHAI CO LTD 2015-08-26 CN disclosed
US-9062028-B2 Bicyclic nitrogen containing heteroaryl TGR5 receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2015-06-23 US disclosed
US-20140080788-A1 NOVEL BICYCLIC NITROGEN CONTAINING HETEROARYL TGR5 RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2014-03-20 US disclosed
EP-2702042-A1 NOVEL BICYCLIC NITROGEN CONTAINING HETEROARYL TGR5 RECEPTOR MODULATORS Bristol-Myers Squibb Company (US) 2014-03-05 EP disclosed
WO-2012149236-A1 NOVEL BICYCLIC NITROGEN CONTAINING HETEROARYL TGR5 RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-11-01 WO 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 (2 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-11767296-B2 Heteroaryl compounds as kinase inhibitor RET, ERBB2, ABL1 MEN1 3204/4885KMT2A 842/4885KDM4E 2697/4885
US-20140080788-A1 NOVEL BICYCLIC NITROGEN CONTAINING HETEROARYL TGR5 RECEPTOR MODULATORS GRK5, GPBAR1, GPR55 MEN1 3428/4885KMT2A 2045/4885KDM4E 1877/4885

“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.