SCHEMBL25490263

SCHEMBL25490263

N#Cc1nc(Cl)nc2c1sc1ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ HTT P42858 1/20 0.39
▸ PSMB8 P28062 1/20 0.39
▸ LIMK1 P53667 1/20 0.39
▸ CDK5 Q00535 1/20 0.39
▸ CDK5R1 Q15078 1/20 0.39
▸ HRH4 Q9H3N8 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ EGLN1 Q9GZT9 1/20 0.38
▸ PIM1 P11309 1/20 0.36
▸ PIM2 Q9P1W9 1/20 0.36
▸ TNKS O95271 1/20 0.36

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
SCHEMBL25490264 0.83 LIMK1 (0.40) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL2534139 0.79 LIMK1 (0.44) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL19119483 0.76 LIMK1 (0.57) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL19325077 0.76 MAPT (0.51) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL16902632 0.74 ALDH1A1 (0.47) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL30646362 0.74 ALDH1A1 (0.47) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL16905650 0.74 HRH4 (0.42) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL2536243 0.73 PIM1 (0.45) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL13992526 0.73 EGFR (0.42) MAPTMEN1KMT2ANPSR1HSD17B10
SCHEMBL1512630 0.72 GPR3 (0.40) MAPTMEN1KMT2ANPSR1KDM4E

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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