SCHEMBL8691033

SCHEMBL8691033

CCCN(Cc1ccc(Oc2ccccc2)cc1)C(=S)C1CC(C(=O)OCc2ccccc2)C1C(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 2/20 0.41
▸ LPAR5 Q9H1C0 2/20 0.41
▸ LMNA P02545 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39

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
SCHEMBL8691846 0.90 LPAR1 (0.42) LPAR1LPAR5
SCHEMBL8497805 0.88 LPAR1 (0.44) LPAR1LPAR5LMNAALDH1A1
SCHEMBL8497804 0.88 LPAR1 (0.44) LPAR1LPAR5LMNAALDH1A1
SCHEMBL8693835 0.86 LPAR1 (0.41) LPAR1LPAR5
SCHEMBL9094043 0.85 FABP7 (0.44) LPAR1LPAR5
SCHEMBL8694938 0.84 LPAR1 (0.44) LPAR1LPAR5LMNAMAPTALOX12
SCHEMBL8694372 0.84 LPAR1 (0.40) LPAR1LPAR5
SCHEMBL8693169 0.84 LPAR1 (0.40) LPAR1LPAR5
SCHEMBL8692064 0.84 TRPM8 (0.40) LPAR1LPAR5ALDH1A1
SCHEMBL9096734 0.82 LPAR1 (0.46) 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
US-5783593-A FUNGICIDE; ANTICHOLESTEROL AGENT ABBOTT LABORATORIES (US) 1998-07-21 — — US disclosed
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