SCHEMBL9569512

SCHEMBL9569512

CCOP(=O)(/C=C/CCCI)OCC

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 4/20 0.37
TSHR P16473 2/20 0.34
LPAR2 Q9HBW0 3/20 0.33
LPAR1 Q92633 2/20 0.33
TP53 P04637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL9569519 1.00 LPAR3 (0.37) LPAR3TSHRLPAR2LPAR1TP53
SCHEMBL9569719 0.88 TSHR (0.37) LPAR3TSHRTP53TDP1
SCHEMBL9569716 0.88 TSHR (0.37) LPAR3TSHRTP53TDP1
SCHEMBL8658473 0.84 LPAR3 (0.47) LPAR3TSHRLPAR2LPAR1TP53
SCHEMBL8658471 0.84 LPAR3 (0.47) LPAR3TSHRLPAR2LPAR1TP53
SCHEMBL2363295 0.82 LPAR3 (0.55) LPAR3TSHRLPAR2LPAR1
SCHEMBL2363294 0.82 LPAR3 (0.55) LPAR3TSHRLPAR2LPAR1
SCHEMBL6542265 0.81 LPAR3 (0.53) LPAR3LPAR2LPAR1
SCHEMBL21638735 0.81 LPAR3 (0.53) LPAR3LPAR2LPAR1
SCHEMBL8052984 0.81 LPAR3 (0.53) LPAR3LPAR2LPAR1

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-0532423-A1 Novel unsaturated acyclic phosphonate derivatives of purine and pyrimidine MERRELL DOW PHARMACEUTICALS INC. (US) 1993-03-17 EP disclosed