SCHEMBL7023191

SCHEMBL7023191

CCC[N]S(=O)(=O)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.36
PRSS1 P07477 2/20 0.36
PRSS2 P07478 2/20 0.36
PRSS3 P35030 2/20 0.36
EPHX1 P07099 1/20 0.33

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
SCHEMBL6002041 0.84 EPHX1 (0.42) EPHX1
SCHEMBL7020097 0.79 F2 (0.39) F2PRSS1PRSS2PRSS3EPHX1
SCHEMBL17226211 0.70 F2 (0.32) F2PRSS1PRSS2PRSS3EPHX1
SCHEMBL17226210 0.68 F2 (0.34) F2PRSS1PRSS2PRSS3
SCHEMBL17226207 0.67 EPHX1 (0.36) F2PRSS1PRSS2PRSS3EPHX1
SCHEMBL736692 0.67
SCHEMBL1362233 0.67
SCHEMBL2016323 0.65
SCHEMBL4483429 0.65
SCHEMBL7121562 0.65 GAA (0.40) F2PRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003106435-A1 FUSED-RING PYRIMIDIN-4(3H)-ONE DERIVATIVES, PROCESSES FOR THE PREPARATION AND USES THEREOF SANKYO COMPANY, LIMITED (JP) 2003-12-24 WO disclosed
EP-0665843-B1 SUBSTITUTED QUINUCLIDINES AS SUBSTANCE P ANTAGONISTS PFIZER (US) 2003-08-13 EP disclosed
US-6194436-B1 THERAPY FOR LUNG CANCER PFIZER INC. 2001-02-27 US disclosed
US-5990125-A NK-1 receptor antagonists for the treatment of cancer PFIZER INC. (US) 1999-11-23 US disclosed
US-5837711-A Substituted quinuclidines as substance P antagonists PFIZER INC. (US) 1998-11-17 US disclosed
EP-0773026-A2 NK-1 receptor antagonists for the treatment of cancer PFIZER INC. (US) 1997-05-14 EP disclosed
US-5569662-A ANTIINFLAMMATORY AGENT, GASTROINTESTINAL DISORDERS, NERVOUS SYSTEM DISORDERS, ANTIASTHMA AGENTS, ANALGESICS PFIZER INC. (US) 1996-10-29 US disclosed
EP-0665843-A1 SUBSTITUTED QUINUCLIDINES AS SUBSTANCE P ANTAGONISTS PFIZER INC. (US) 1995-08-09 EP disclosed
EP-0632809-A1 QUINUCLIDINE DERIVATIVES AS SUBSTANCE P ANTAGONISTS PFIZER INC. (US) 1995-01-11 EP disclosed
WO-1994010170-A1 SUBSTITUTED QUINUCLIDINES AS SUBSTANCE P ANTAGONISTS PFIZER INC. (US) 1994-05-11 WO disclosed
WO-1993019064-A1 QUINUCLIDINE DERIVATIVES AS SUBSTANCE P ANTAGONISTS PFIZER INC. (US) 1993-09-30 WO disclosed