SCHEMBL9842927

SCHEMBL9842927

CCCCCCCCCCC(=O)OC1(O)C=CC(c2ccccc2)C=C1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.40
CES1 P23141 2/20 0.40
POLM Q9NP87 1/20 0.40
POLK Q9UBT6 1/20 0.40
POLL Q9UGP5 1/20 0.40
POLH Q9Y253 1/20 0.40
PPARG P37231 3/20 0.39
EPHX2 P34913 1/20 0.38
SOAT1 P35610 2/20 0.38
PTPN1 P18031 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
RECQL P46063 1/20 0.37
PAM P19021 2/20 0.37
DGKA P23743 1/20 0.36

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
SCHEMBL8380021 0.86 CES2 (0.40) CES2CES1POLMPOLKPOLL
SCHEMBL9331791 0.86 CES2 (0.40) CES2CES1POLMPOLKPOLL
SCHEMBL9574875 0.84 CES2 (0.38) CES2CES1POLMPOLKPOLL
SCHEMBL10449056 0.79 PPARG (0.42) PPARGMEN1KMT2ARECQL
SCHEMBL21224652 0.79 PPARG (0.42) PPARGMEN1KMT2ARECQL
SCHEMBL10445787 0.76 MAPT (0.34) CES2CES1POLMPOLKPOLL
SCHEMBL9852426 0.74 PPARG (0.50) PPARGKDM4E
SCHEMBL9852458 0.74 OPRM1 (0.39) CES2CES1PPARG
SCHEMBL9746013 0.73 PPARG (0.39) CES2CES1PPARG
SCHEMBL10440676 0.73 PPARG (0.39) CES2CES1PPARG

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-0413989-A2 Liquid crystal compounds Showa Shell Sekiyu Kabushiki Kaisha (JP) 1991-02-27 EP disclosed