SCHEMBL25490606

SCHEMBL25490606

N#Cc1nc(C#N)c2oc3cc(-c4ccc5c(c4)sc4ccc(-c6ccc7c(c6)sc6ccccc67)cc45)ccc3c2n1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ ESR2 Q92731 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
SCHEMBL25490605 0.89 ADORA2A (0.35) ADORA2AALDH1A1MAPTHPGDRAB9A
SCHEMBL25485787 0.84 ADORA2A (0.31) ADORA2A
SCHEMBL25485125 0.83 ADORA2A (0.40) ADORA2AALDH1A1MAPT
SCHEMBL25484257 0.80 ADORA2A (0.41) ADORA2AALDH1A1MAPTHPGD
SCHEMBL25484878 0.79 ADORA2A (0.39) ADORA2AALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL25485629 0.78 PIM1 (0.39) MAPT
SCHEMBL25485628 0.76 ADORA2A (0.40) ADORA2AALDH1A1MAPTHPGD
SCHEMBL25484777 0.76 ADORA2A (0.41) ADORA2AALDH1A1MAPTHPGDRAB9A
SCHEMBL25178518 0.76 ADORA2A (0.49) ADORA2AALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL31758995 0.76 PIM1 (0.45) ADORA2AALDH1A1MAPTHPGD

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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