SCHEMBL6504818

SCHEMBL6504818

Cc1sc(-c2cc(Cl)cc(Cl)c2)nc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
KDM4E B2RXH2 2/20 0.44
POLB P06746 2/20 0.44
NPC1 O15118 1/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
PIN1 Q13526 1/20 0.40
GAA P10253 1/20 0.40
RARA P10276 1/20 0.39
RARB P10826 1/20 0.39
RARG P13631 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
KMO O15229 1/20 0.37
TPMT P51580 1/20 0.37
PTGER1 P34995 1/20 0.36

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
SCHEMBL6496085 0.84 KDM4E (0.63) RAB9ASMN1; SMN2KDM4EPOLBNPC1
SCHEMBL3417072 0.80 KDM4E (0.61) RAB9ASMN1; SMN2KDM4EPOLBNPC1
SCHEMBL6495754 0.80 MDM2 (0.47) RAB9ASMN1; SMN2KDM4EPOLBNPC1
SCHEMBL3995172 0.78 RARA (0.60) SMN1; SMN2KDM4ENPC1KMT2AMEN1
SCHEMBL8867854 0.77 RAB9A (0.72) RAB9ASMN1; SMN2KDM4EPOLBNPC1
SCHEMBL6503762 0.76 SHMT1 (0.56) RAB9ASMN1; SMN2KDM4ENPC1MAPT
SCHEMBL6496395 0.75 PIN1 (0.54) SMN1; SMN2KDM4EKMT2AMEN1MAPT
SCHEMBL18004048 0.75 KDM4E (0.41) RAB9ASMN1; SMN2KDM4EPOLBNPC1
SCHEMBL6503223 0.74 RARA (0.49) RAB9ASMN1; SMN2KDM4EPOLBNPC1
SCHEMBL6498884 0.73 DAO (0.44) RAB9ASMN1; SMN2KDM4EPOLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed