SCHEMBL6502484

SCHEMBL6502484

CCc1sc(-c2ccc(C)cc2)nc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
KDM4E B2RXH2 4/20 0.55
RAB9A P51151 2/20 0.55
GAA P10253 1/20 0.55
TRPM8 Q7Z2W7 2/20 0.48
ALDH1A1 P00352 2/20 0.48
PTGDR2 Q9Y5Y4 2/20 0.46
MAPT P10636 3/20 0.46
TP53 P04637 2/20 0.46
GFER P55789 1/20 0.44
ALOX5 P09917 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.42
LMNA P02545 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL6602729 0.88 L3MBTL1 (0.74) L3MBTL1KDM4ETRPM8ALDH1A1PTGDR2
SCHEMBL6503373 0.87 L3MBTL1 (0.57) L3MBTL1KDM4ERAB9AGAATRPM8
SCHEMBL27500333 0.85 L3MBTL1 (0.56) L3MBTL1KDM4ERAB9AGAATRPM8
SCHEMBL5238288 0.85 L3MBTL1 (0.58) L3MBTL1KDM4EALDH1A1PTGDR2
SCHEMBL18003085 0.84 L3MBTL1 (0.78) L3MBTL1KDM4ERAB9AGAATRPM8
SCHEMBL12875848 0.83 L3MBTL1 (0.56) L3MBTL1KDM4ETRPM8ALDH1A1PTGDR2
SCHEMBL5341433 0.82 L3MBTL1 (0.55) L3MBTL1KDM4EPTGDR2MEN1KMT2A
SCHEMBL3417072 0.81 KDM4E (0.61) KDM4ERAB9AGAATRPM8ALDH1A1
SCHEMBL6495707 0.80 L3MBTL1 (0.44) L3MBTL1KDM4ERAB9AGAAALDH1A1
SCHEMBL6431720 0.77 L3MBTL1 (0.56) L3MBTL1KDM4ERAB9AGAATRPM8

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