SCHEMBL6955348

SCHEMBL6955348

CCOC(Cc1ccc(OCCn2cnc3ccccc3c2=O)cc1)C(=O)OC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.63
HTT P42858 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
GAA P10253 2/20 0.57
ALDH1A1 P00352 1/20 0.57
CYP2C9 P11712 1/20 0.57
HPGD P15428 1/20 0.57
CYP2C19 P33261 1/20 0.57
LMNA P02545 3/20 0.56
RAB9A P51151 2/20 0.56
NPSR1 Q6W5P4 1/20 0.55
PPARG P37231 3/20 0.52
PPARA Q07869 3/20 0.52
PPARD Q03181 1/20 0.52
POLB P06746 3/20 0.50
NPC1 O15118 1/20 0.50
RECQL P46063 1/20 0.49
MAPK10 P53779 1/20 0.49

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
SCHEMBL6556018 0.94 MAPK1 (0.59) MAPK1HTTSMN1; SMN2MEN1KMT2A
SCHEMBL6555749 0.91 PPARG (0.64) MAPK1HTTSMN1; SMN2MEN1KMT2A
SCHEMBL6952971 0.84 SMN1; SMN2 (0.65) MAPK1SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL6948727 0.84 PPARG (0.56) RAB9APPARGPPARAPPARD
SCHEMBL6957070 0.83 MAPK1 (0.60) MAPK1HTTSMN1; SMN2MEN1KMT2A
SCHEMBL6950858 0.81 MAPK1 (0.60) MAPK1HTTSMN1; SMN2MEN1KMT2A
SCHEMBL6948903 0.81 MAPK1 (0.57) MAPK1HTTSMN1; SMN2MEN1KMT2A
SCHEMBL6955465 0.80 MAPK1 (0.59) MAPK1HTTSMN1; SMN2MEN1KMT2A
SCHEMBL6957110 0.80 MAPK1 (0.62) MAPK1HTTSMN1; SMN2MEN1KMT2A
SCHEMBL6956607 0.80 HTT (0.63) MAPK1HTTSMN1; SMN2MEN1KMT2A

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