SCHEMBL7735649

SCHEMBL7735649

COCCOc1c(C2=NCCN2)cc2ccccc2c1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 8/20 0.50
MAOA P21397 2/20 0.40
MAOB P27338 2/20 0.40
PDCD1LG2 Q9BQ51 8/20 0.38
CD274 Q9NZQ7 8/20 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
Hydrochloric Acid SCHEMBL7736300 0.99 NISCH (0.49) NISCHMAOAMAOBPDCD1LG2CD274
Hydrochloric Acid SCHEMBL7736810 0.91 NISCH (0.48) NISCHPDCD1LG2CD274
SCHEMBL6824307 0.91 NISCH (0.48) NISCHMAOAMAOBPDCD1LG2CD274
SCHEMBL4255962 0.90 NISCH (0.52) NISCHPDCD1LG2CD274
Hydrochloric Acid SCHEMBL7738678 0.90 NISCH (0.47) NISCHMAOAMAOBPDCD1LG2CD274
Hydrochloric Acid SCHEMBL7736132 0.89 NISCH (0.53) NISCHPDCD1LG2CD274
Hydrochloric Acid SCHEMBL7735647 0.89 NISCH (0.50) NISCHPDCD1LG2CD274
Hydrochloric Acid SCHEMBL7736327 0.88 NISCH (0.49) NISCHMAOAMAOBPDCD1LG2CD274
Hydrochloric Acid SCHEMBL7738672 0.87 NISCH (0.53) NISCHMAOBPDCD1LG2CD274
SCHEMBL6825150 0.87 NISCH (0.53) NISCHMAOAMAOBPDCD1LG2CD274

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-6410562-B1 ANTIDIABETIC AGENTS ELI LILLY AND COMPANY 2002-06-25 US disclosed