SCHEMBL9797263

SCHEMBL9797263

Nc1ccc(C(=O)O)cc1Nc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.76
KDM4E B2RXH2 6/20 0.76
MAPT P10636 6/20 0.76
ALDH1A1 P00352 4/20 0.76
HSD17B10 Q99714 3/20 0.76
THRB P10828 2/20 0.76
HPGD P15428 2/20 0.76
CDC25B P30305 4/20 0.60
MAPK13 O15264 3/20 0.57
MAPK12 P53778 3/20 0.57
MAPK11 Q15759 3/20 0.57
MAPK14 Q16539 3/20 0.57
GFER P55789 4/20 0.56
NPC1 O15118 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
HCAR3 P49019 1/20 0.55
CDC25A P30304 1/20 0.54
CDC25C P30307 1/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53

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
SCHEMBL15762048 0.91 GAA (0.63) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL12965243 0.88 GAA (0.60) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL12965125 0.87 GAA (0.58) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL2342942 0.86 GAA (1.00) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL12965015 0.85 GAA (0.56) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL1842379 0.85 KDM4E (0.60) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL12965121 0.84 GAA (0.62) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL4640305 0.84 MAPT (0.72) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL2476797 0.81 MAPT (0.63) GAAKDM4EMAPTALDH1A1HSD17B10
SCHEMBL16634589 0.81 MAPK13 (0.78) GAAKDM4EMAPTALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0231373-B1 A PROCESS FOR THE PRODUCTION OF A LIQUID CRYSTALLINE EXTENDED CHAIN POLYMER COMPOSITION THE DOW CHEMICAL COMPANY (US) 1991-01-30 EP disclosed
EP-0231373-A4 A PROCESS FOR THE PRODUCTION OF A LIQUID CRYSTALLINE EXTENDED CHAIN POLYMER COMPOSITION. COMMTECH INTERNAT (US) 1988-12-22 EP disclosed
US-4772678-A HIGH-MOLECULAR-WEIGHT CHAIN-EXTENDED N-HETEROCYCLIC POLYMERS PREPARED USING A NON-OXIDIZING STRONG ACID AS SOLVENT; HIGH-STRENGTH FIBERS, FILMS, FIBRIDS AND STRUCTURES COMMTECH INTERNATIONAL MANAGEMENT CORPORATION (US) 1988-09-20 US disclosed
EP-0231373-A1 A PROCESS FOR THE PRODUCTION OF A LIQUID CRYSTALLINE EXTENDED CHAIN POLYMER COMPOSITION. COMMTECH INT (US) 1987-08-12 EP disclosed
WO-1987000844-A1 A PROCESS FOR THE PRODUCTION OF A LIQUID CRYSTALLINE EXTENDED CHAIN POLYMER COMPOSITION COMMTECH INTERNATIONAL (US) 1987-02-12 WO disclosed