SCHEMBL8497804

CCCN(Cc1ccc(Oc2ccccc2)cc1)C(=S)[C@@H]1[C@H](C(=O)OCc2ccccc2)[C@@H](C(=O)OCc2ccccc2)[C@H]1C(=S)N(CCC)Cc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	LPAR1	Q92633	2/20	0.44

▸	LPAR5	Q9H1C0	2/20	0.44

▸	LMNA	P02545	1/20	0.43

▸	ALDH1A1	P00352	1/20	0.43

▸	FABP7	O15540	1/20	0.42

▸	FABP5	Q01469	1/20	0.42

▸	MMP2	P08253	1/20	0.42

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.

Compound	similarity	top predicted	shared targets
SCHEMBL8497805	1.00	LPAR1 (0.44)	LPAR1LPAR5LMNAALDH1A1FABP7
SCHEMBL9094043	0.97	FABP7 (0.44)	LPAR1LPAR5FABP7FABP5
SCHEMBL9096734	0.89	LPAR1 (0.46)	LPAR1LPAR5FABP7FABP5
SCHEMBL8691033	0.88	LPAR1 (0.41)	LPAR1LPAR5LMNAALDH1A1
SCHEMBL8496537	0.87	LPAR1 (0.49)	LPAR1LPAR5LMNA
SCHEMBL8496540	0.87	LPAR1 (0.49)	LPAR1LPAR5LMNA
SCHEMBL9094317	0.86	FABP7 (0.46)	LPAR1LPAR5FABP7FABP5
SCHEMBL9094513	0.86	FABP7 (0.46)	LPAR1LPAR5FABP7FABP5
SCHEMBL8497898	0.84	ALOX5 (0.44)	LPAR1LPAR5
SCHEMBL8497894	0.84	ALOX5 (0.44)	LPAR1LPAR5

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0677039-B1	CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE	ABBOTT LAB (US)	1999-03-10	—	—	EP	disclosed
WO-1995012572-A1	CYCLOBUTANE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE	ABBOTT LABORATORIES (US)	1995-05-11	—	—	WO	disclosed