SCHEMBL5962390

SCHEMBL5962390

COCCN1CCN(C(=O)Cl)CC1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.58
DRD3 P35462 7/20 0.43
NAMPT P43490 1/20 0.41
DRD2 P14416 3/20 0.41
KMT2A Q03164 2/20 0.41
KCNA5 P22460 3/20 0.40
KDM4E B2RXH2 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 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
SCHEMBL4550356 0.82 DRD3 (0.59) HSD11B1DRD3NAMPTDRD2KDM4E
SCHEMBL3052320 0.82 HSD11B1 (0.55) HSD11B1DRD3NAMPTDRD2KMT2A
SCHEMBL3939911 0.81 HSD11B1 (0.54) HSD11B1DRD3NAMPTDRD2KMT2A
SCHEMBL3216394 0.81 HSD11B1 (0.54) HSD11B1DRD3NAMPTDRD2KMT2A
SCHEMBL12395531 0.79 DRD3 (0.61) HSD11B1DRD3NAMPTDRD2KMT2A
SCHEMBL8149011 0.78 HSD11B1 (0.47) HSD11B1KMT2AKDM4ETDP1NPC1
SCHEMBL4893194 0.78 HSD11B1 (0.47) HSD11B1KMT2AKDM4ETDP1NPC1
SCHEMBL6057032 0.78
SCHEMBL16281565 0.78 HSD11B1 (0.51) HSD11B1DRD3NAMPTDRD2KMT2A
SCHEMBL22281656 0.78 HSD11B1 (0.51) HSD11B1DRD3NAMPTDRD2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7026336-B1 4-pyridinylimidazol-2-ylhydrocarbyl amine, (thio)urea, carbamic acid or sulfonamide derivatives, e.g., (2-(4-(4-Chloro-3-methoxy-phenyl)-5-pyridin-4-yl-1H-imidazol-2-yl)-2-methyl-propyl)-carbamic acid tert-butyl ester; Raf kinase inhibitors for the treatment of neurotraumatic diseases SMITHKLINE BEECHAM P.L.C. (GB) 2006-04-11 US disclosed
EP-1232153-B1 IMIDAZOLE DERIVATIVES AND THEIR USE AS RAF KINASE INHIBITORS SMITHKLINE BEECHAM PLC (GB) 2004-11-03 EP disclosed
EP-1232153-A2 IMIDAZOLE DERIVATIVES AND THEIR USE AS RAF KINASE INHIBITORS SMITHKLINE BEECHAM PLC (GB) 2002-08-21 EP disclosed
WO-2001038324-A2 IMIDAZOLE DERIVATIVES AND THEIR USE AS RAF KINASE INHIBITORS SMITHKLINE BEECHAM P.L.C. (GB) 2001-05-31 WO disclosed