SCHEMBL27632007

SCHEMBL27632007

Cn1ncc(C=O)c1-c1ccc(CN)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 2/20 0.40
BRD4 O60885 1/20 0.40
PRMT5 O14744 7/20 0.40
WDR77 Q9BQA1 7/20 0.40
HRH3 Q9Y5N1 1/20 0.38
NSD2 O96028 1/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
DUSP3 P51452 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
AKT2 P31751 1/20 0.36
CYP2A6 P11509 1/20 0.35
TAAR1 Q96RJ0 1/20 0.34
ADRB2 P07550 1/20 0.34
HIF1A Q16665 1/20 0.34
ASIC3 Q9UHC3 1/20 0.34
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
PTK2 Q05397 1/20 0.34

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
SCHEMBL27613169 0.82 CCNC (0.46) BPTFBRD4PRMT5WDR77RAB9A
SCHEMBL4829311 0.81 RAB9A (0.43) PRMT5WDR77RAB9ASMN1; SMN2DUSP3
SCHEMBL4829107 0.80 PRMT5 (0.40) PRMT5WDR77RAB9ASMN1; SMN2HIF1A
SCHEMBL4836369 0.80 PTGS2 (0.42) RAB9ASMN1; SMN2HIF1ANPC1LMNA
SCHEMBL3630473 0.80 NR3C2 (0.41) BPTFPRMT5WDR77HIF1ALMNA
SCHEMBL4836837 0.79 LMNA (0.46) PRMT5WDR77RAB9ASMN1; SMN2HIF1A
SCHEMBL4831072 0.77 MEN1 (0.44) PRMT5WDR77CYP2A6LMNAMAPT
SCHEMBL28806382 0.76 HRH3 (0.42) BPTFBRD4PRMT5WDR77HRH3
SCHEMBL4831559 0.76 PDE2A (0.42) LMNA
SCHEMBL27945783 0.74 PRMT5 (0.35) BPTFBRD4PRMT5WDR77HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1731994-A Prophylactic and therapeutic agent for neuropathy TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2006-02-08 CN disclosed