SCHEMBL8102443

SCHEMBL8102443

CC(C)(C)CN1C(=O)C(CC(=O)O)SC(c2ccccc2Cl)c2cc(Cl)ccc21

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 9/20 0.44
POLB P06746 1/20 0.38

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
SCHEMBL4110616 1.00 FDFT1 (0.44) FDFT1POLB
SCHEMBL8110789 0.90 FDFT1 (0.48) FDFT1
SCHEMBL4110079 0.90 FDFT1 (0.48) FDFT1
SCHEMBL4112897 0.90 FDFT1 (0.38) FDFT1
SCHEMBL8116382 0.90 FDFT1 (0.38) FDFT1
SCHEMBL8111693 0.89 FDFT1 (0.41) FDFT1POLB
SCHEMBL8636201 0.89 FDFT1 (0.43) FDFT1
SCHEMBL8636205 0.89 FDFT1 (0.43) FDFT1
SCHEMBL8636199 0.89 FDFT1 (0.43) FDFT1
SCHEMBL8118252 0.89 FDFT1 (0.53) FDFT1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0645378-B1 Condensed seven- or eight-membered heterocyclic compounds useful as squalene synthetase inhibitors TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-08-23 EP claimed
JP-7179429-A None JP disclosed
EP-0645378-B1 Condensed seven- or eight-membered heterocyclic compounds useful as squalene synthetase inhibitors TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-08-23 EP disclosed
US-5698691-A ANTICHOLESTEROL AGENT; SYNTHETASE INHIBITOR; FUNGICIDE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-12-16 US disclosed
JP-H07179429-A CONDENSED RING COMPOUND AND ITS USE TAKEDA CHEM IND LTD 1995-07-18 JP disclosed
EP-0645378-A1 Condensed seven- or eight-membered heterocyclic compounds useful as squalene synthetase inhibitors Takeda Chemical Industries, Ltd. (JP) 1995-03-29 EP disclosed