SCHEMBL9712592

SCHEMBL9712592

COCCCCCCCCC/C=C/C(F)(F)Cl

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LPAR2 Q9HBW0 3/20 0.33
LPAR3 Q9UBY5 3/20 0.33
LPAR1 Q92633 2/20 0.33
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL9712599 1.00 LPAR2 (0.33) LPAR2LPAR3LPAR1ALDH1A1
SCHEMBL9712648 0.80 FAAH (0.40) LPAR2LPAR3LPAR1
SCHEMBL9712641 0.80 FAAH (0.40) LPAR2LPAR3LPAR1
SCHEMBL9712786 0.74
SCHEMBL9712721 0.74
SCHEMBL9712783 0.74
SCHEMBL9712567 0.74 FAAH (0.32)
SCHEMBL9712562 0.74 FAAH (0.32)
SCHEMBL9712718 0.74
SCHEMBL11318550 0.73 LPAR3 (0.43) LPAR2LPAR3LPAR1ALDH1A1

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
US-5081287-A Pesticidal polyhalo alkenoic acid esters FMC CORPORATION (US) 1992-01-14 US disclosed