SCHEMBL8692009

SCHEMBL8692009

CCCOC(=O)C1CC(C(=O)N(CCC)Cc2ccc(Oc3ccccc3)cc2)C1C(=O)O

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 2/20 0.42
▸ LPAR5 Q9H1C0 2/20 0.42
▸ MAPT P10636 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ ADAM17 P78536 1/20 0.37

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
SCHEMBL8695186 0.95 LPAR1 (0.41) LPAR1LPAR5
SCHEMBL8696664 0.93 PPARG (0.43) LPAR1LPAR5
SCHEMBL8696604 0.93 LPAR1 (0.42) LPAR1LPAR5ADAM17
SCHEMBL8691985 0.92 PPARG (0.42) LPAR1LPAR5
SCHEMBL8693835 0.91 LPAR1 (0.41) LPAR1LPAR5
SCHEMBL8691477 0.90 LPAR1 (0.45) LPAR1LPAR5MAPT
SCHEMBL8694285 0.90 LPAR1 (0.46) LPAR1LPAR5
SCHEMBL8691812 0.90 LPAR1 (0.46) LPAR1LPAR5
SCHEMBL8698291 0.90 LPAR1 (0.46) LPAR1LPAR5
SCHEMBL8691859 0.90 LPAR1 (0.40) LPAR1LPAR5ADAM17

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-5783593-A FUNGICIDE; ANTICHOLESTEROL AGENT ABBOTT LABORATORIES (US) 1998-07-21 — — US disclosed
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