SCHEMBL6973351

SCHEMBL6973351

Nc1nc(Cc2ccc(Cl)cc2)cc(C2CCN(C(=O)c3ccccc3)CC2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.52
DRD4 P21917 1/20 0.52
DRD3 P35462 1/20 0.52
MGLL Q99685 5/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MAP3K12 Q12852 1/20 0.46
MAPT P10636 1/20 0.44
HSP90AB1 P08238 1/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 1/20 0.44
CDK1 P06493 1/20 0.43
IGF1R P08069 1/20 0.43
FGFR1 P11362 1/20 0.43
BRAF P15056 1/20 0.43
FGFR2 P21802 1/20 0.43
FGFR4 P22455 1/20 0.43
FGFR3 P22607 1/20 0.43
JAK1 P23458 1/20 0.43
CDK2 P24941 1/20 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
SCHEMBL6976878 0.88 HSD11B1 (0.51) MEN1KMT2AMAP3K12LMNAALDH1A1
SCHEMBL6974879 0.85 DRD2 (0.65) DRD2DRD4DRD3MGLLMEN1
SCHEMBL6975639 0.85 MAP3K12 (0.49) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL6969942 0.79 MAP3K12 (0.60) DRD2DRD4DRD3MAP3K12LMNA
SCHEMBL6972446 0.76 HSD17B10 (0.48) LMNAALDH1A1
SCHEMBL6980741 0.76 HPGD (0.47) MGLLMEN1KMT2ALMNAALDH1A1
SCHEMBL6976438 0.76 NPC1 (0.45) MGLLKMT2ALMNA
SCHEMBL6979916 0.76 ALDH1A1 (0.43) MEN1KMT2ALMNAALDH1A1
SCHEMBL6980066 0.75 ALDH1A1 (0.48) MEN1KMT2ALMNAALDH1A1
SCHEMBL19716357 0.75 HRH4 (0.56) DRD2DRD4DRD3MEN1KMT2A

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
EP-0892795-B1 PIPERIDINYLPYRAMIDINE DERIVATIVES SUMITOMO PHARMA (JP) 2003-01-08 EP disclosed
US-5948786-A BLOCKING TUMOR NECROSIS FACTOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1999-09-07 US disclosed
EP-0892795-A1 PIPERIDINYLPYRAMIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1999-01-27 EP disclosed
WO-1997038992-A1 PIPERIDINYLPYRAMIDINE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1997-10-23 WO disclosed