SCHEMBL9000515

SCHEMBL9000515

CCCCC1CCC(C(F)(F)C(=O)Nc2c(SC)cc(C)nc2SC)CC1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SOAT1 P35610 6/20 0.36
▸ HPGD P15428 1/20 0.30
▸ NAAA Q02083 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30

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
SCHEMBL9000803 0.86 SOAT1 (0.37) SOAT1
SCHEMBL9000829 0.82 SOAT1 (0.37) SOAT1HPGDKDM4E
SCHEMBL8325945 0.72 SOAT1 (0.47) SOAT1HPGDKDM4E
SCHEMBL8326103 0.72 SOAT1 (0.47) SOAT1HPGDKDM4E
SCHEMBL9000921 0.69 SOAT1 (0.41) SOAT1HPGD
SCHEMBL9000483 0.69 SOAT1 (0.41) SOAT1HPGD
SCHEMBL9000736 0.69 SOAT1 (0.41) SOAT1HPGD
SCHEMBL9008152 0.69 SOAT1 (0.36) SOAT1KDM4E
SCHEMBL8323636 0.68 SOAT1 (0.38) SOAT1
SCHEMBL4985295 0.68 SOAT1 (0.50) SOAT1HPGD

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-5583147-A INHIBITORS OF ACYL-COENZYME A: CHOLESTEROL O-TRANSFERASE; ANTIHYPERCHOLESTEROLEMIC AND/OR ANTIATHEROSCLEROTIC AGENTS THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1996-12-10 — — US disclosed
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