SCHEMBL6955219

SCHEMBL6955219

CCOC(Cc1ccc(CCCn2cnc3ccccc3c2=O)cc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.50
PPARG P37231 6/20 0.50
PPARD Q03181 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
RECQL P46063 1/20 0.49
MAPK10 P53779 1/20 0.49
ALDH1A1 P00352 1/20 0.48
POLB P06746 3/20 0.48
TP53 P04637 2/20 0.48
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
THRB P10828 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL6555749 0.87 PPARG (0.64) PPARAPPARGPPARDSMN1; SMN2ALDH1A1
SCHEMBL6951014 0.85 SMN1; SMN2 (0.50) SMN1; SMN2RECQLMAPK10ALDH1A1POLB
SCHEMBL6950862 0.83 TNF (0.55) PPARAPPARGPPARD
SCHEMBL6956586 0.82 ALDH1A1 (0.50) PPARAPPARGPPARDSMN1; SMN2ALDH1A1
SCHEMBL6556018 0.79 MAPK1 (0.59) PPARAPPARGPPARDSMN1; SMN2RECQL
SCHEMBL6955348 0.78 MAPK1 (0.63) PPARAPPARGPPARDSMN1; SMN2RECQL
SCHEMBL7532542 0.77 PPARA (0.72) PPARAPPARGPPARD
SCHEMBL7852911 0.77 PPARA (0.72) PPARAPPARGPPARD
SCHEMBL6752363 0.76 PPARA (0.54) PPARAPPARGPPARD
SCHEMBL7535616 0.76 PPARA (0.66) PPARAPPARGPPARD

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