SCHEMBL11060384

SCHEMBL11060384

CCOC(=O)c1cc2[nH]c3ccccc3n2n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 5/20 0.62
KDM4E B2RXH2 3/20 0.48
GABRP O00591 2/20 0.48
GABRD O14764 2/20 0.48
GABRA1 P14867 2/20 0.48
GABRB1 P18505 2/20 0.48
GABRG2 P18507 2/20 0.48
GABRB3 P28472 2/20 0.48
GABRA5 P31644 2/20 0.48
GABRA3 P34903 2/20 0.48
GABRA2 P47869 2/20 0.48
GABRB2 P47870 2/20 0.48
GABRA4 P48169 2/20 0.48
GABRE P78334 2/20 0.48
GABRA6 Q16445 2/20 0.48
GABRG1 Q8N1C3 2/20 0.48
GABRG3 Q99928 2/20 0.48
GABRQ Q9UN88 2/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPT P10636 2/20 0.48

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
SCHEMBL16695820 0.84 ADORA3 (0.61) ADORA3KDM4EGABRPGABRDGABRA1
SCHEMBL12100311 0.79 PARP1 (0.43) ADORA3KDM4EGABRPGABRDGABRA1
SCHEMBL11266931 0.77 ADORA3 (1.00) ADORA3KDM4EGABRPGABRDGABRA1
SCHEMBL4710332 0.76 ADORA3 (0.52) ADORA3KDM4EGABRA2GABRB2ALDH1A1
SCHEMBL11391453 0.76 ADORA3 (0.77) ADORA3KDM4EGABRPGABRDGABRA1
SCHEMBL31001905 0.75 ADORA3 (0.56) ADORA3ALDH1A1MAPTLMNACYP1A2
SCHEMBL13741609 0.74 ADORA3 (0.56) ADORA3KDM4EALDH1A1NPC1KMT2A
SCHEMBL9741346 0.74 GABRP (0.43) ADORA3KDM4EGABRPGABRDGABRA1
SCHEMBL31052736 0.74 ADORA3 (0.50) ADORA3KDM4EGABRPGABRDGABRA1
SCHEMBL16289633 0.72 CNR1 (0.42) ADORA3

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
US-4461827-A Color photographic recording material containing a non-diffusible dye releaser from which a complexible azo dye is released during development AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) 1984-07-24 US disclosed