SCHEMBL6947290

SCHEMBL6947290

CCOC(Cc1ccc(OCCn2nnc3ccccc3c2=O)cc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.67
RAB9A P51151 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
PPARG P37231 16/20 0.63
PPARA Q07869 16/20 0.63
PPARD Q03181 4/20 0.63
POLB P06746 1/20 0.55

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
SCHEMBL6952459 0.92 SMN1; SMN2 (0.66) NPC1RAB9ASMN1; SMN2PPARGPPARA
SCHEMBL6952971 0.91 SMN1; SMN2 (0.65) NPC1RAB9ASMN1; SMN2PPARGPPARA
SCHEMBL6956586 0.87 ALDH1A1 (0.50) NPC1RAB9ASMN1; SMN2PPARGPPARA
SCHEMBL6955359 0.84 SMN1; SMN2 (0.63) NPC1RAB9ASMN1; SMN2POLB
SCHEMBL6945113 0.84 SMN1; SMN2 (0.63) NPC1RAB9ASMN1; SMN2PPARGPOLB
SCHEMBL6555749 0.84 PPARG (0.64) NPC1RAB9ASMN1; SMN2PPARGPPARA
SCHEMBL8127443 0.84 PPARG (0.64) PPARGPPARAPPARD
SCHEMBL6555630 0.83 PPARG (0.69) PPARGPPARAPPARD
SCHEMBL6947575 0.83 PPARG (0.63) NPC1RAB9APPARGPPARAPPARD
SCHEMBL6555767 0.82 PPARG (0.68) PPARGPPARAPPARD

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
EP-0903343-B1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP CO LTD (JP) 2003-05-28 EP disclosed
EP-0903343-A1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP Co., Ltd. (JP) 1999-03-24 EP disclosed