SCHEMBL9059710

SCHEMBL9059710

O=C(NC1CN2CCC1CC2)c1cnc2ccccc2c1O

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.53
HTR3A P46098 1/20 0.53

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
SCHEMBL9059703 1.00 CHRNA7 (0.53) CHRNA7HTR3A
Pumosetrag SCHEMBL1497800 0.81 HTR3A (0.56) CHRNA7HTR3A
Pumosetrag SCHEMBL1497797 0.81 HTR3A (0.56) CHRNA7HTR3A
Pumosetrag SCHEMBL7287985 0.81 HTR3A (0.56) CHRNA7HTR3A
Pumosetrag SCHEMBL9432501 0.80 HTR3A (0.55) CHRNA7HTR3A
Pumosetrag SCHEMBL9432490 0.80 HTR3A (0.55) CHRNA7HTR3A
SCHEMBL6101482 0.77
SCHEMBL6098306 0.77 HTR3A (0.74) CHRNA7HTR3A
SCHEMBL23722904 0.76 USP30 (0.63) CHRNA7HTR3A
Hydrochloric Acid SCHEMBL6100277 0.76 HTR3A (0.72) CHRNA7HTR3A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8311066-A None JP disclosed
JP-H08311066-A NEW 4-OXOQUINOLINECARBOXAMIDE DERIVATIVE OR ITS SALT YAMANOUCHI PHARMACEUT CO LTD 1996-11-26 JP disclosed