SCHEMBL10840819

SCHEMBL10840819

Cc1c(-c2ccccc2)c2nncn2c2ccc(N)cc12

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 13/20 0.47
▸ ADORA1 P30542 5/20 0.47
▸ ADORA2B P29275 5/20 0.43
▸ ALDH1A1 P00352 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ POLB P06746 2/20 0.41
▸ ADORA3 P0DMS8 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ TACR1 P25103 1/20 0.38

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
SCHEMBL10842673 0.72 MAPT (0.45) ALDH1A1POLBSMN1; SMN2
SCHEMBL19036207 0.69 GRIN2D (0.41) MAPK1POLBHPGDHSD17B10SMN1; SMN2
SCHEMBL13792628 0.68 KMT2A (0.47) ALDH1A1TSHRMAPK1POLBKDM4E
SCHEMBL10840813 0.67 SMN1; SMN2 (0.55) ALDH1A1TSHRMAPK1POLBKDM4E
SCHEMBL28317970 0.67 KMT2A (0.43) ALDH1A1TSHRMAPK1POLBKDM4E
SCHEMBL23578069 0.65 EGFR (0.47) ALDH1A1SMN1; SMN2
SCHEMBL29909077 0.65 EGFR (0.47) ALDH1A1SMN1; SMN2
SCHEMBL11146964 0.64 ADORA2A (0.67) ADORA2AADORA1ADORA2BADORA3
SCHEMBL21581848 0.64 ADORA2A (1.00) ADORA2AADORA1ADORA2BADORA3
SCHEMBL21581744 0.64 ADORA2A (1.00) ADORA2AADORA1ADORA2BADORA3

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
EP-0174833-A2 Triazoloquinoline derivatives MAY & BAKER LIMITED (GB) 1986-03-19 — — EP disclosed
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