SCHEMBL7429005

SCHEMBL7429005

Cc1cccc2c(=O)n(C3CN4CCC3CC4)ccc12

nearest known ligand 0.97

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 5/20 0.52

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
SCHEMBL7446472 1.00 HTR3A (0.52) HTR3A
SCHEMBL7438440 1.00 HTR3A (0.52) HTR3A
Hydrochloric Acid SCHEMBL7439892 0.99 HTR3A (0.51) HTR3A
Hydrochloric Acid SCHEMBL7439900 0.99 HTR3A (0.51) HTR3A
Hydrochloric Acid SCHEMBL7442557 0.99 HTR3A (0.51) HTR3A
SCHEMBL7432161 0.84 HTR3A (0.51) HTR3A
SCHEMBL7435486 0.84 HTR3A (0.51) HTR3A
SCHEMBL7432154 0.84 HTR3A (0.51) HTR3A
SCHEMBL4379271 0.84 HTR3A (0.52) HTR3A
Hydrochloric Acid SCHEMBL7448668 0.83 HTR3A (0.50) HTR3A

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
US-5491148-A TREATING GASTROINTESTINAL, CARDIOVASCULAR, CENTRAL NERVOUS SYSTEM DISORDERS, EMESIS, PAIN SYNTEX (U.S.A.) INC. (US) 1996-02-13 US claimed
US-5491148-A TREATING GASTROINTESTINAL, CARDIOVASCULAR, CENTRAL NERVOUS SYSTEM DISORDERS, EMESIS, PAIN SYNTEX (U.S.A.) INC. (US) 1996-02-13 US disclosed