SCHEMBL9634266

SCHEMBL9634266

CCc1ccc(OC(CC)P(=O)(O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
CYP2C19 P33261 1/20 0.53
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
SRC P12931 1/20 0.40
ANPEP P15144 1/20 0.40
ERAP2 Q6P179 1/20 0.40
LMNA P02545 1/20 0.39
KDM4E B2RXH2 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
POLB P06746 1/20 0.38
ALDH1A1 P00352 1/20 0.37
PLK1 P53350 1/20 0.37

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
SCHEMBL9632933 0.84 ACP3 (0.49) ANPEPERAP2
SCHEMBL8758965 0.84 POLB (0.59) SMN1; SMN2CYP2C19PPARGPPARALMNA
SCHEMBL9632945 0.83 MMP2 (0.44) SMN1; SMN2CYP2C19PPARGPPARALMNA
SCHEMBL9632963 0.83 ALDH1A1 (0.45) SMN1; SMN2PPARGPPARALMNAALDH1A1
SCHEMBL9785223 0.82 CYP2C9 (0.44) CYP2C19SRCANPEPALDH1A1
SCHEMBL9633981 0.76 KMT2A (0.54) SMN1; SMN2LMNAPOLBALDH1A1
SCHEMBL8986920 0.74 SLC6A4 (0.47)
SCHEMBL10253314 0.72 ENPP2 (0.47) SMN1; SMN2CYP2C19POLB
Phosphoric Acid SCHEMBL28176643 0.72 SMN1; SMN2 (0.59) SMN1; SMN2CYP2C19SRCALDH1A1PLK1
SCHEMBL1101448 0.72 CYP2C19 (0.72) SMN1; SMN2CYP2C19SRCRXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0276124-B1 PROSTAGLANDIN DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE Sankyo Company Limited (JP) 1992-05-20 EP disclosed