SCHEMBL25490264

SCHEMBL25490264

N#Cc1nc(C#N)c2sc3ccccc3c2n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 1/20 0.40
▸ CDK5 Q00535 1/20 0.40
▸ CDK5R1 Q15078 1/20 0.40
▸ HRH4 Q9H3N8 2/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ EGLN1 Q9GZT9 1/20 0.39
▸ MAPT P10636 3/20 0.38
▸ TNKS O95271 2/20 0.37
▸ TNKS2 Q9H2K2 2/20 0.37
▸ PIM1 P11309 1/20 0.37
▸ PIM2 Q9P1W9 1/20 0.37
▸ KRAS P01116 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ HTR2C P28335 1/20 0.35

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
SCHEMBL25485629 0.86 PIM1 (0.39) LIMK1EGLN1MAPTTNKSTNKS2
SCHEMBL25490263 0.83 MAPT (0.42) LIMK1CDK5CDK5R1HRH4MEN1
SCHEMBL17030414 0.83 MAPT (0.48) LIMK1CDK5CDK5R1HRH4MEN1
SCHEMBL25484466 0.79 LIMK1 (0.45) LIMK1PIM1PIM2
SCHEMBL25484787 0.77 ALOX5 (0.41) LIMK1PIM1PIM2
SCHEMBL25490266 0.75 EGLN1 (0.41) MEN1KMT2ANPSR1KDM4ETSHR
SCHEMBL25484460 0.74 PIM1 (0.35) LIMK1PIM1PIM2
SCHEMBL1512630 0.73 GPR3 (0.40) LIMK1CDK5CDK5R1MEN1KMT2A
SCHEMBL14629295 0.73 GPR3 (0.41) LIMK1CDK5CDK5R1KDM4EEGLN1
SCHEMBL25484880 0.71 LIMK1 (0.35) LIMK1EGLN1PIM1PIM2PIK3CA

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
WO-2023078812-A1 BENZOFURO[3,2-D]PYRIMIDINO-2,4-DICARBONITRIL DERIVATIVES AND SIMILAR COMPOUNDS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2023-05-11 — — WO disclosed
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