SCHEMBL8636199

SCHEMBL8636199

CC(C)(C)CN1C(=O)[C@H](CC(=O)O)S[C@@H](c2cccc3ccccc23)c2cc(Cl)ccc21

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 10/20 0.43
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CCR4 P51679 3/20 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
SCHEMBL8636205 1.00 FDFT1 (0.43) FDFT1ALDH1A1LMNAMAPTHTT
SCHEMBL8636201 1.00 FDFT1 (0.43) FDFT1ALDH1A1LMNAMAPTHTT
SCHEMBL8685814 0.92 CCR4 (0.38) FDFT1ALDH1A1LMNAMAPTHTT
SCHEMBL8685812 0.92 CCR4 (0.38) FDFT1ALDH1A1LMNAMAPTHTT
SCHEMBL8685818 0.92 CCR4 (0.38) FDFT1ALDH1A1LMNAMAPTHTT
SCHEMBL8685094 0.91 FDFT1 (0.38) FDFT1ALDH1A1LMNAMAPTHTT
SCHEMBL8684367 0.90 GSK3B (0.36) FDFT1ALDH1A1LMNAMAPTHTT
SCHEMBL8684377 0.90 GSK3B (0.36) FDFT1ALDH1A1LMNAMAPTHTT
SCHEMBL8684371 0.90 GSK3B (0.36) FDFT1ALDH1A1LMNAMAPTHTT
SCHEMBL8684150 0.89 ALDH1A1 (0.39) FDFT1ALDH1A1MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5770594-A ANTICHOLESTEROL AGENTS, INHIBITORS OF CHOLESTEROL SYNTHESIS PFIZER INC. (US) 1998-06-23 US claimed
EP-0782451-A1 COMBINATION OF A CHOLESTEROL ABSORPTION INHIBITOR AND A CHOLESTEROL SYNTHESIS INHIBITOR PFIZER INC. (US) 1997-07-09 EP claimed
WO-1996020184-A1 NAPHTHYL-BENZOXAZEPINES OR -BENZOTHIAZEPINES AS SQUALENE SYNTHETASE INHIBITORS PFIZER INC. (US) 1996-07-04 WO claimed
WO-1996009827-A2 COMBINATION OF A CHOLESTEROL ABSORPTION INHIBITOR AND A CHOLESTEROL SYNTHESIS INHIBITOR PFIZER INC. (US) 1996-04-04 WO claimed
US-5807834-A ANTICHOLESTEROL AGENTS PFIZER INC. (US) 1998-09-15 US disclosed
US-5770594-A ANTICHOLESTEROL AGENTS, INHIBITORS OF CHOLESTEROL SYNTHESIS PFIZER INC. (US) 1998-06-23 US disclosed
EP-0782451-A1 COMBINATION OF A CHOLESTEROL ABSORPTION INHIBITOR AND A CHOLESTEROL SYNTHESIS INHIBITOR PFIZER INC. (US) 1997-07-09 EP disclosed
WO-1996020184-A1 NAPHTHYL-BENZOXAZEPINES OR -BENZOTHIAZEPINES AS SQUALENE SYNTHETASE INHIBITORS PFIZER INC. (US) 1996-07-04 WO disclosed
WO-1996009827-A2 COMBINATION OF A CHOLESTEROL ABSORPTION INHIBITOR AND A CHOLESTEROL SYNTHESIS INHIBITOR PFIZER INC. (US) 1996-04-04 WO disclosed