SCHEMBL9716262

SCHEMBL9716262

CCCCCCCCCCCCCCCCCCOCC(COS(C)(=O)=O)OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKD3 O94806 2/20 0.55
▸ PRKCG P05129 2/20 0.55
▸ PRKCB P05771 2/20 0.55
▸ PRKCA P17252 2/20 0.55
▸ PRKCH P24723 2/20 0.55
▸ PRKCI P41743 2/20 0.55
▸ PRKCE Q02156 2/20 0.55
▸ PRKCQ Q04759 2/20 0.55
▸ PRKCZ Q05513 2/20 0.55
▸ PRKCD Q05655 2/20 0.55
▸ PRKD1 Q15139 2/20 0.55
▸ LPAR1 Q92633 8/20 0.54
▸ LPAR3 Q9UBY5 8/20 0.54
▸ LPAR5 Q9H1C0 4/20 0.54
▸ LPAR2 Q9HBW0 4/20 0.54
▸ LPAR6 P43657 3/20 0.54
▸ LPAR4 Q99677 3/20 0.54
▸ AKT1 P31749 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ MAPK1 P28482 1/20 0.48

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
SCHEMBL10550605 1.00 PRKD3 (0.55) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL10551115 0.87 PRKD3 (0.49) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL16475728 0.87 LPAR1 (0.56) LPAR1LPAR3LPAR2PLA2G2CUSP2
SCHEMBL17184093 0.87 LPAR1 (0.56) LPAR1LPAR3LPAR2PLA2G2CUSP2
SCHEMBL102381 0.87 LPAR1 (0.56) LPAR1LPAR3LPAR2PLA2G2CUSP2
SCHEMBL11299536 0.87 LPAR1 (0.56) LPAR1LPAR3LPAR2PLA2G2CUSP2
SCHEMBL11299532 0.87 LPAR1 (0.56) LPAR1LPAR3LPAR2PLA2G2CUSP2
SCHEMBL11299539 0.87 LPAR1 (0.56) LPAR1LPAR3LPAR2PLA2G2CUSP2
SCHEMBL8912777 0.85 LPAR1 (0.48) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL4401638 0.84 PRKD3 (0.72) PRKD3PRKCGPRKCBPRKCAPRKCH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5103007-A Antitumor agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-04-07 — — US disclosed
EP-0378763-A1 Lipids, their production and use Takeda Chemical Industries, Ltd. (JP) 1990-07-25 — — EP disclosed
US-4845219-A ANTITUMOR, ANTOCOAGULANT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-07-04 — — US disclosed
EP-0255366-A2 Nitrogen- and sulfur-containing lipid compound, their production and use Takeda Chemical Industries, Ltd. (JP) 1988-02-03 — — EP disclosed
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