SCHEMBL9094576

SCHEMBL9094576

CCCN(Cc1ccc(Oc2ccccc2)cc1)C(=O)C1C(C(=O)OC)C(C(=O)OCc2ccccc2)C1C(=O)N(CCC)Cc1ccc(Oc2ccccc2)cc1.CCN(C=O)CC

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 4/20 0.40
▸ LPAR5 Q9H1C0 4/20 0.40
▸ FABP7 O15540 1/20 0.40
▸ FABP5 Q01469 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
SCHEMBL9092996 0.91 LPAR1 (0.43) LPAR1LPAR5
SCHEMBL9096734 0.89 LPAR1 (0.46) LPAR1LPAR5FABP7FABP5
SCHEMBL9094513 0.86 FABP7 (0.46) LPAR1LPAR5FABP7FABP5
SCHEMBL9094317 0.86 FABP7 (0.46) LPAR1LPAR5FABP7FABP5
SCHEMBL7761028 0.86 FABP7 (0.46) LPAR1LPAR5FABP7FABP5
SCHEMBL7762923 0.86 FABP7 (0.46) LPAR1LPAR5FABP7FABP5
SCHEMBL7762918 0.86 FABP7 (0.46) LPAR1LPAR5FABP7FABP5
SCHEMBL7761033 0.86 FABP7 (0.46) LPAR1LPAR5FABP7FABP5
SCHEMBL8826200 0.86 LPAR1 (0.51) LPAR1LPAR5
SCHEMBL8497079 0.86 LPAR1 (0.51) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996034850-A1 CYCLOBUTANE DERIVATIVES AND THEIR USE AS INHIBITORS OF PROTEIN FARNESYLTRANSFERASE ABBOTT LABORATORIES (US) 1996-11-07 — — WO disclosed
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