SCHEMBL28928751

SCHEMBL28928751

N#Cc1cc(Br)cc(C#N)n1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CHEK1 O14757 1/20 0.35
GLA P06280 1/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GPR35 Q9HC97 1/20 0.33
KDM4E B2RXH2 2/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
TTR P02766 1/20 0.32
ALB P02768 1/20 0.32
NQO1 P15559 1/20 0.31
HTT P42858 1/20 0.31
MAPK1 P28482 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL1795983 0.84 KDM4E (0.38) MEN1KMT2APOLBSMN1; SMN2KDM4E
SCHEMBL25120101 0.84 KDM4E (0.34) MEN1KMT2ACHEK1GLAPOLB
SCHEMBL29238904 0.79 MBOAT4 (0.34)
SCHEMBL3098852 0.79 CTSK (0.34) MEN1KMT2AHPGDKDM4EMAPT
SCHEMBL26690256 0.79 RECQL (0.43) HPGDSMN1; SMN2KDM4EGAAMAPT
SCHEMBL3080824 0.79 GABRA1 (0.36)
SCHEMBL31039307 0.79 NT5E (0.38) HPGDGPR35KDM4EGAA
SCHEMBL3101735 0.79 NT5E (0.38) HPGDGPR35KDM4EGAA
SCHEMBL28675605 0.76 SMN1; SMN2 (0.58) MEN1KMT2AGLAPOLBHPGD
SCHEMBL16125570 0.74 RAD51 (0.37) MEN1KMT2AGLAPOLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115403562-A 2',6' -di-2- (1-hydrogen imidazolyl) -4-halogenated pyridine compound and preparation method and application thereof 深圳大学 2022-11-29 CN claimed
CN-115403562-A 2',6' -di-2- (1-hydrogen imidazolyl) -4-halogenated pyridine compound and preparation method and application thereof 深圳大学 2022-11-29 CN disclosed