SCHEMBL8850299

SCHEMBL8850299

CCCCCC(O)c1cccc(/C=C/CCCCO)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 2/20 0.45
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 3/20 0.44
MTOR P42345 2/20 0.44
PMP22 Q01453 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C9 P11712 2/20 0.44
NFKB1 P19838 2/20 0.44
ALOX15 P16050 1/20 0.44
KDM4E B2RXH2 1/20 0.44
PLIN1 O60240 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
PLIN5 Q00G26 1/20 0.44
ABHD5 Q8WTS1 1/20 0.44
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL8850303 1.00 LTB4R (0.45) LTB4RALDH1A1MAPK1MTORPMP22
SCHEMBL8849767 0.89 LTB4R (0.44) LTB4RALDH1A1MAPK1MTORPMP22
SCHEMBL8849572 0.89 LTB4R (0.44) LTB4RALDH1A1MAPK1MTORPMP22
SCHEMBL8849756 0.89 LTB4R (0.44) LTB4RALDH1A1MAPK1MTORPMP22
SCHEMBL8849584 0.89 LTB4R (0.44) LTB4RALDH1A1MAPK1MTORPMP22
SCHEMBL8849559 0.84 LTB4R (0.43) LTB4RALDH1A1MAPK1MTORPMP22
SCHEMBL8849832 0.84 LTB4R (0.64) LTB4RALDH1A1CYP3A4NFKB1ALOX15
SCHEMBL8849878 0.84 LTB4R (0.64) LTB4RALDH1A1CYP3A4NFKB1ALOX15
SCHEMBL8870066 0.84 LTB4R (0.64) LTB4RALDH1A1CYP3A4NFKB1ALOX15
SCHEMBL8849575 0.84 LTB4R (0.43) LTB4RALDH1A1MAPK1MTORPMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0650953-B1 Cyclised analogs of metabolites of fatty acids, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1997-06-04 EP disclosed
US-5599975-A ANTICOAGULANTS ADIR ET COMPAGNIE (FR) 1997-02-04 US disclosed
EP-0650953-A1 Cyclised analogs of metabolites of fatty acids, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1995-05-03 EP disclosed