SCHEMBL25490262

SCHEMBL25490262

N#Cc1nc(C#N)c2c(n1)oc1ccccc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSMB8 P28062 1/20 0.37
▸ ALOX15 P16050 2/20 0.35
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ LMNA P02545 2/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ ALDH1A1 P00352 9/20 0.34
▸ KDM4E B2RXH2 6/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ CYP2A6 P11509 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ HPGD P15428 4/20 0.34
▸ POLB P06746 3/20 0.34
▸ HSD17B10 Q99714 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ DUSP3 P51452 1/20 0.34
▸ PTPN5 P54829 1/20 0.34
▸ PTPN11 Q06124 1/20 0.34
▸ EGFR P00533 2/20 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
SCHEMBL25485790 0.86 KDM4E (0.36) SMN1; SMN2ADORA2AALDH1A1KDM4ECYP2A6
SCHEMBL25484667 0.84 ALOX15 (0.34) ALOX15LMNAALDH1A1KDM4EHPGD
SCHEMBL25490260 0.83 ALDH1A1 (0.38) PSMB8ALOX15SMN1; SMN2LMNAADORA2A
SCHEMBL25484668 0.80 ALOX15 (0.33) ALOX15ADORA2AALDH1A1KDM4EHPGD
SCHEMBL25491283 0.80 HSD17B10 (0.37) HPGDHSD17B10KMT2A
SCHEMBL25485000 0.78 ALDH1A1 (0.34) ALOX15SMN1; SMN2ALDH1A1KDM4EL3MBTL1
SCHEMBL25178518 0.75 ADORA2A (0.49) ALOX15SMN1; SMN2LMNAADORA2AALDH1A1
SCHEMBL9227645 0.72 ADORA2A (0.43) PSMB8ALOX15SMN1; SMN2ADORA2AALDH1A1
SCHEMBL22652363 0.70 L3MBTL1 (0.37) ALOX15SMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL25490426 0.68 ALOX5 (0.40) PSMB8ALOX15SMN1; SMN2ADORA2AALDH1A1

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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