SCHEMBL8692635

SCHEMBL8692635

COCCN(Cc1ccc(Oc2ccccc2)cc1)C(=O)C1CC(C(=O)O)C1C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ LPAR1 Q92633 2/20 0.41
▸ LPAR5 Q9H1C0 2/20 0.41

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
SCHEMBL8698291 0.89 LPAR1 (0.46) LPAR1LPAR5
SCHEMBL8691812 0.89 LPAR1 (0.46) LPAR1LPAR5
SCHEMBL8694285 0.89 LPAR1 (0.46) LPAR1LPAR5
SCHEMBL8695548 0.89 NR3C1 (0.43) —
SCHEMBL8691182 0.88 NR3C1 (0.45) —
SCHEMBL8696184 0.87 LPAR1 (0.47) LPAR1LPAR5
SCHEMBL8692216 0.87 LPAR1 (0.50) LPAR1LPAR5
SCHEMBL8693992 0.87 MEN1 (0.40) —
SCHEMBL8691497 0.87 LPAR1 (0.44) LPAR1LPAR5
SCHEMBL8826083 0.87 HDAC1 (0.48) HDAC1HDAC6LPAR1LPAR5

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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