SCHEMBL11087008

SCHEMBL11087008

CCOC(=O)c1nc2c3cc(C)ccc3n(C)c(=O)n2n1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 9/20 0.57
ADORA2A P29274 1/20 0.46
ELANE P08246 1/20 0.46
LMNA P02545 1/20 0.43

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
SCHEMBL11082791 0.89 ADORA3 (0.61) ADORA3ADORA2ALMNA
Melquinast SCHEMBL2109337 0.88 ADORA3 (0.56) ADORA3ADORA2AELANE
SCHEMBL11083828 0.87 ADORA3 (0.52) ADORA3ADORA2A
SCHEMBL11083161 0.86 ADORA3 (0.51) ADORA3ADORA2ALMNA
SCHEMBL11087927 0.86 ADORA3 (0.67) ADORA3ELANE
SCHEMBL11089403 0.86 ADORA3 (0.55) ADORA3ADORA2A
SCHEMBL11087802 0.85 MAPT (0.56) ADORA3ELANELMNA
SCHEMBL11079707 0.83 ADORA3 (0.52) ADORA3ADORA2ALMNA
SCHEMBL10926346 0.83 LMNA (0.42) ADORA3ELANELMNA
SCHEMBL11086256 0.83 ADORA3 (0.49) ADORA3ADORA2AELANELMNA

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-4463007-A ANTIALLERGENS BASF AKTIENGESELLSCHAFT (DE) 1984-07-31 US disclosed