SCHEMBL6637754

SCHEMBL6637754

Cc1cc(N)c2ncccc2n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.59
NCF1 P14598 1/20 0.55
LMNA P02545 1/20 0.46
NR4A2 P43354 2/20 0.42
ALDH1A1 P00352 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TOP1 P11387 1/20 0.41
HRH4 Q9H3N8 1/20 0.41
CCR1 P32246 2/20 0.41
CCR8 P51685 2/20 0.41
CASP6 P55212 2/20 0.41
NSD2 O96028 1/20 0.41
G6PD P11413 1/20 0.41
MMP9 P14780 1/20 0.40
CYP1A2 P05177 1/20 0.40
TLR8 Q9NR97 1/20 0.40
TLR7 Q9NYK1 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL8284604 0.81 PRMT5 (0.68) PRMT5NCF1LMNAALDH1A1TOP1
SCHEMBL23676516 0.81 PRMT5 (0.68) PRMT5LMNAALDH1A1CASP1HSD17B10
SCHEMBL6636369 0.78 PRMT5 (0.50) PRMT5TOP1CCR1CCR8CASP6
SCHEMBL28332633 0.78 PRMT5 (0.50) PRMT5LMNAALDH1A1CASP1HSD17B10
SCHEMBL9709737 0.78 PRMT5 (0.50) PRMT5LMNANR4A2ALDH1A1TOP1
SCHEMBL20468597 0.78 PRMT5 (0.50) PRMT5NCF1LMNAALDH1A1HSD17B10
SCHEMBL9709781 0.77 PRMT5 (0.54) PRMT5LMNATOP1HRH4CASP6
SCHEMBL14666994 0.75 PRMT5 (0.47) PRMT5NCF1LMNAALDH1A1TOP1
SCHEMBL10266505 0.75 PRMT5 (0.47) PRMT5NCF1ALDH1A1TOP1CCR1
Quinoline SCHEMBL28231960 0.75 NCF1 (0.75) NCF1NR4A2ALDH1A1CASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144409-B1 PHENYL UREA AND PHENYL THIOUREA DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2004-11-17 EP disclosed
US-6596730-B1 Phenyl urea and phenyl thiourea derivatives SMITHKLINE BEECHAM P.L.C. (GB) 2003-07-22 US disclosed
EP-1144409-A2 PHENYL UREA AND PHENYL THIOUREA DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2001-10-17 EP disclosed
WO-2000047576-A1 CINNAMIDE DERIVATIVES AS OREXIN-1 RECEPTORS ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 2000-08-17 WO disclosed
WO-2000047580-A2 PHENYL UREA AND PHENYL THIOUREA DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2000-08-17 WO disclosed
WO-1992022533-A1 4-AMINOQUINOLINES AND PHARMACEUTICAL COMPOSITIONS THEREOF THE UPJOHN COMPANY (US) 1992-12-23 WO disclosed