SCHEMBL2145007

SCHEMBL2145007

CNN1Cc2ccc(Br)cc2C1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 2/20 0.42
HSD17B3 P37058 4/20 0.41
DPP8 Q6V1X1 1/20 0.40
DPP9 Q86TI2 1/20 0.40
DPP7 Q9UHL4 1/20 0.40
ABHD6 Q9BV23 1/20 0.39
BRD4 O60885 1/20 0.39
NAMPT P43490 2/20 0.37
PNMT P11086 4/20 0.37
ADRA2A P08913 3/20 0.37
ADRA2B P18089 3/20 0.37
ADRA2C P18825 3/20 0.37
ASIC3 Q9UHC3 2/20 0.36
PRMT5 O14744 1/20 0.35
L3MBTL3 Q96JM7 1/20 0.35
METAP1 P53582 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
SCHEMBL11974589 0.78 DPP8 (0.39) DPP8DPP9DPP7NAMPTMETAP1
SCHEMBL1782140 0.77 BRD4 (0.46) CARM1HSD17B3DPP8DPP9DPP7
SCHEMBL15983781 0.77 HSD17B3 (0.41) CARM1HSD17B3DPP8DPP9DPP7
SCHEMBL11974013 0.76 DPP9 (0.44) DPP8DPP9DPP7NAMPT
Hydrochloric Acid SCHEMBL1026718 0.76 DPP8 (0.38) DPP8DPP9DPP7NAMPTMETAP1
Hydrochloric Acid SCHEMBL1028134 0.74 DPP9 (0.43) DPP8DPP9DPP7NAMPT
SCHEMBL11973938 0.73 MAOA (0.44) CARM1NAMPT
SCHEMBL11975918 0.73 DRD1 (0.47) METAP1
SCHEMBL6125818 0.73 ABHD6 (0.38) CARM1HSD17B3DPP8DPP9DPP7
SCHEMBL18782916 0.72 DPP8 (0.43) CARM1HSD17B3DPP8DPP9DPP7

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
EP-2344494-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS Signal Pharmaceuticals, LLC (US) 2011-07-20 EP disclosed
WO-2010027500-A1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2010-03-11 WO disclosed