SCHEMBL4764708

SCHEMBL4764708

[CH2][C@@H](C(=O)N1CCCC1)C1CCN(C2CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.38
DPP7 Q9UHL4 4/20 0.38
L3MBTL3 Q96JM7 11/20 0.37
L3MBTL1 Q9Y468 10/20 0.37
CHRM1 P11229 1/20 0.37
MBTD1 Q05BQ5 4/20 0.37
TP53BP1 Q12888 2/20 0.37
L3MBTL4 Q8NA19 1/20 0.37
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL4771158 0.81 TP53 (0.42) DPP4DPP7L3MBTL3L3MBTL1
SCHEMBL5520698 0.70 ALDH1A1 (0.52) CYP3A4CYP2C19
SCHEMBL3958979 0.70 ALDH1A1 (0.52) CYP3A4CYP2C19
SCHEMBL3951101 0.69 ALDH1A1 (0.55) DPP4DPP7
SCHEMBL25605709 0.69 CHRM1 (0.43) L3MBTL3L3MBTL1CHRM1CYP3A4CYP2C19
SCHEMBL24838380 0.69 CHRM1 (0.43) L3MBTL3L3MBTL1CHRM1CYP3A4CYP2C19
SCHEMBL3955574 0.69 ALDH1A1 (0.55) DPP4DPP7
SCHEMBL18251701 0.66 CYP3A4 (0.52) L3MBTL3L3MBTL1CHRM1MBTD1TP53BP1
SCHEMBL15504825 0.64 MTNR1A (0.43) CHRM1CYP3A4CYP2C19
SCHEMBL12396446 0.64 CYP3A4 (0.55) L3MBTL3L3MBTL1CHRM1MBTD1TP53BP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572678-A4 SUBSTITUTED N-PHENYL SULFONAMIDE BRADYKININ ANTAGONISTS ELAN PHARM INC (US) 2008-05-07 EP claimed
EP-1572678-A2 SUBSTITUTED N-PHENYL SULFONAMIDE BRADYKININ ANTAGONISTS Elan Pharmaceuticals, Inc. (US) 2005-09-14 EP claimed
EP-1501807-A1 SULFONYLQUINOXALONE ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ ANTAGONISTS Elan Pharmaceuticals, Inc. (US) 2005-02-02 EP claimed
WO-2004056319-A2 SUBSTITUTED N-PHENYL SULFONAMIDE BRADYKININ ANTAGONISTS ELAN PHARMACEUTICALS INC. (US) 2004-07-08 WO claimed
WO-2003093245-A1 SULFONYLQUINOXALONE ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ ANTAGONISTS ELAN PHARMACEUTICALS, INC. (US) 2003-11-13 WO claimed
EP-1572678-A4 SUBSTITUTED N-PHENYL SULFONAMIDE BRADYKININ ANTAGONISTS ELAN PHARM INC (US) 2008-05-07 EP disclosed
EP-1572678-A2 SUBSTITUTED N-PHENYL SULFONAMIDE BRADYKININ ANTAGONISTS Elan Pharmaceuticals, Inc. (US) 2005-09-14 EP disclosed
EP-1501807-A1 SULFONYLQUINOXALONE ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ ANTAGONISTS Elan Pharmaceuticals, Inc. (US) 2005-02-02 EP disclosed
WO-2004056319-A2 SUBSTITUTED N-PHENYL SULFONAMIDE BRADYKININ ANTAGONISTS ELAN PHARMACEUTICALS INC. (US) 2004-07-08 WO disclosed
WO-2003093245-A1 SULFONYLQUINOXALONE ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ ANTAGONISTS ELAN PHARMACEUTICALS, INC. (US) 2003-11-13 WO disclosed