SCHEMBL11084243

SCHEMBL11084243

CCCCCCCCC1CCC(CCCCCCCCSCC(COP(=O)(O)O)OC)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 6/20 0.48
LPAR3 Q9UBY5 8/20 0.45
LPAR1 Q92633 7/20 0.45
PRKD3 O94806 3/20 0.44
PRKCG P05129 3/20 0.44
PRKCB P05771 3/20 0.44
PRKCA P17252 3/20 0.44
PRKCH P24723 3/20 0.44
PRKCI P41743 3/20 0.44
PRKCE Q02156 3/20 0.44
PRKCQ Q04759 3/20 0.44
PRKCZ Q05513 3/20 0.44
PRKCD Q05655 3/20 0.44
PRKD1 Q15139 3/20 0.44
LPAR5 Q9H1C0 4/20 0.40
LPAR6 P43657 3/20 0.40
LPAR4 Q99677 3/20 0.40
LPAR2 Q9HBW0 3/20 0.40
AKT1 P31749 2/20 0.40
PLCG2 P16885 1/20 0.40

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
SCHEMBL11087950 0.89 ENPP2 (0.58) ENPP2LPAR3LPAR1PRKD3PRKCG
SCHEMBL11078070 0.89 ENPP2 (0.58) ENPP2LPAR3LPAR1PRKD3PRKCG
SCHEMBL8677600 0.89 ENPP2 (0.58) ENPP2LPAR3LPAR1PRKD3PRKCG
Phosphoric Acid SCHEMBL11084239 0.86 PRKD3 (0.46) ENPP2LPAR3LPAR1PRKD3PRKCG
SCHEMBL11087665 0.85 LPAR3 (0.59) ENPP2LPAR3LPAR1PRKD3PRKCG
SCHEMBL11085679 0.85 LPAR3 (0.59) ENPP2LPAR3LPAR1PRKD3PRKCG
SCHEMBL11081529 0.83 LPAR3 (0.59) ENPP2LPAR3LPAR1PRKD3PRKCG
SCHEMBL11089242 0.82 ENPP2 (0.63) ENPP2LPAR3LPAR1LPAR5LPAR6
SCHEMBL11090082 0.81 ENPP2 (0.50) ENPP2LPAR3LPAR1PRKD3PRKCG
SCHEMBL11088836 0.79 ENPP2 (0.60) ENPP2LPAR3LPAR1LPAR5LPAR6

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-4444766-A ANTITUMOR BOEHRINGER MANNHEIM GMBH (DE) 1984-04-24 US disclosed