SCHEMBL7369250

SCHEMBL7369250

CC(C)(C)OC(=O)CN1C(=O)C(N)CSc2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2 P00734 3/20 0.49
F7 P08709 1/20 0.49
F3 P13726 1/20 0.49
NPSR1 Q6W5P4 1/20 0.46
CCKBR P32239 2/20 0.43

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
SCHEMBL7369254 1.00 F2 (0.49) F2F7F3NPSR1CCKBR
SCHEMBL11066807 0.87 LMNA (0.54) F2F7F3NPSR1
SCHEMBL8881927 0.85 NPSR1 (0.65) F2F7F3NPSR1
SCHEMBL8881932 0.85 NPSR1 (0.65) F2F7F3NPSR1
Hydrochloric Acid SCHEMBL11015861 0.84 NPSR1 (0.64) F2F7F3NPSR1
Hydrochloric Acid SCHEMBL7869708 0.84 NPSR1 (0.64) F2F7F3NPSR1
SCHEMBL9690349 0.83 CCKBR (0.52) CCKBR
SCHEMBL8104212 0.83 NPSR1 (0.43) NPSR1CCKBR
SCHEMBL9826366 0.83 NPSR1 (0.43) NPSR1CCKBR
SCHEMBL9802560 0.82 F2 (0.55) F2F7F3NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4539150-A HYPOTENSIVE AGENTS, SULFIDING, CYCLIZATION MITSUI TOATSU CHEMICALS, INC. (JP) 1985-09-03 US claimed
US-5618808-A Benzothiazepine and benzoxazepine derivatives as cholecystokinin receptor antagonists PFIZER, INC. (US) 1997-04-08 US disclosed
WO-1994001421-A1 BENZOTHIAZEPINE AND BENZOXAZEPINE DERIVATIVES AS CHOLECYSTOKININ RECEPTOR ANTAGONISTS PFIZER INC. (US) 1994-01-20 WO disclosed
EP-0125056-B1 CONDENSED, SEVEN-MEMBERED RING COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1991-01-16 EP disclosed
US-4882326-A HYPOTENSIVE AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-11-21 US disclosed
EP-0292923-A2 Piperidine compounds and pharmaceutical uses thereof Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-11-30 EP disclosed
US-4739066-A HYPOTENSIVE AGENTS, ANGIOTENSIN INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-04-19 US disclosed
US-4638000-A HYPOTENSIVES, ANGIOTENSIN INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-01-20 US disclosed
US-4564612-A ANGIOTENSION CONVERTING ENZYME INHIBITORS, HYPOTENSIVE AGENTS, BENZOTHIAZEPINES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-01-14 US disclosed
EP-0156455-A2 Condensed seven-membered ring compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1985-10-02 EP disclosed
US-4539150-A HYPOTENSIVE AGENTS, SULFIDING, CYCLIZATION MITSUI TOATSU CHEMICALS, INC. (JP) 1985-09-03 US disclosed
EP-0125056-A2 Condensed, seven-membered ring compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1984-11-14 EP disclosed