SCHEMBL10460643

SCHEMBL10460643

Cn1c(-c2ccccc2)cc(=O)c(C(=O)O)c1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.51
ALDH1A1 P00352 6/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
KDM4E B2RXH2 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MTHFD2 P13995 1/20 0.43
COMT P21964 1/20 0.43
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
GABRA1 P14867 1/20 0.40

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
SCHEMBL10462655 0.98 HPGD (0.50) HPGDALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL10463389 0.93 HPGD (0.46) HPGDALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL10462125 0.92 HPGD (0.44) HPGDALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL10463516 0.92 HPGD (0.44) HPGDALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL10463383 0.86 USP2 (0.42) HPGDALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL10462205 0.86 GABRA1 (0.53) HPGDALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL10462415 0.86 KMT2A (0.42) HPGDALDH1A1KDM4EATML3MBTL1
SCHEMBL10462654 0.86 HPGD (0.48) HPGDALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL10462369 0.85 USP2 (0.41) HPGDALDH1A1SMN1; SMN2KDM4ENPC1
SCHEMBL10463700 0.85 KMT2A (0.41) HPGDALDH1A1KDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4964896-A GAMETOCIDES MONSANTO COMPANY (US) 1990-10-23 US disclosed
US-4936904-A Aryl-4-oxonicotinates useful for inducing male sterility in cereal grain plants MONSANTO TECHNOLOGY LLC 1990-06-26 US disclosed
US-4714492-A HYBRIDIZATION AGENTS ROHM AND HAAS COMPANY (US) 1987-12-22 US disclosed