SCHEMBL25484257

SCHEMBL25484257

N#Cc1nc(C#N)c2oc3cc(-c4cc(-c5ccccc5)cc(-c5ccc(-c6ccccc6)cc5)c4)ccc3c2n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 1/20 0.41
▸ PIM1 P11309 1/20 0.34
▸ CSNK2A2 P19784 1/20 0.34
▸ CSNK2B P67870 1/20 0.34
▸ PIM3 Q86V86 1/20 0.34
▸ PIM2 Q9P1W9 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ HPGD P15428 3/20 0.33
▸ HSD17B10 Q99714 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ EGLN2 Q96KS0 2/20 0.33
▸ EGLN1 Q9GZT9 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33

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
SCHEMBL25485125 0.91 ADORA2A (0.40) ADORA2APIM1CSNK2A2CSNK2BPIM3
SCHEMBL25485624 0.90 PIM1 (0.43) ADORA2APIM1CSNK2A2CSNK2BPIM3
SCHEMBL25484253 0.88 PIM1 (0.43) ADORA2APIM1CSNK2A2CSNK2BPIM3
SCHEMBL25177539 0.88 PIM1 (0.45) ADORA2APIM1CSNK2A2CSNK2BPIM3
SCHEMBL31758995 0.88 PIM1 (0.45) ADORA2APIM1CSNK2A2CSNK2BPIM3
SCHEMBL25484884 0.86 ADORA2A (0.41) ADORA2APIM1CSNK2A2CSNK2BPIM3
SCHEMBL25484779 0.85 PIM1 (0.43) ADORA2APIM1CSNK2A2CSNK2BPIM3
SCHEMBL25485628 0.83 ADORA2A (0.40) ADORA2APIM1CSNK2A2CSNK2BPIM3
SCHEMBL25485003 0.83 ADORA2A (0.39) ADORA2APIM1CSNK2A2CSNK2BPIM3
SCHEMBL25485004 0.83 PIM1 (0.40) ADORA2APIM1CSNK2A2CSNK2BPIM3

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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