SCHEMBL9323388

SCHEMBL9323388

CCc1ccccc1N(C)[C@@H]1C2CCN(CC2)[C@@H]1C(c1ccccc1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 15/20 0.58
CACNA1F O60840 1/20 0.46
CHRM5 P08912 1/20 0.46
CACNA1D Q01668 1/20 0.46
CACNA1S Q13698 1/20 0.46
CACNA1C Q13936 1/20 0.46
TMEM97 Q5BJF2 1/20 0.46
GPR65 Q8IYL9 1/20 0.46
NPC1 O15118 1/20 0.46
MTOR P42345 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL9767413 0.88 TACR1 (0.56) TACR1CACNA1FCHRM5CACNA1DCACNA1S
SCHEMBL9321841 0.88 TACR1 (0.56) TACR1CACNA1FCHRM5CACNA1DCACNA1S
SCHEMBL9323196 0.86 TACR1 (0.54) TACR1CACNA1FCHRM5CACNA1DCACNA1S
SCHEMBL9325160 0.84 TACR1 (0.53) TACR1
SCHEMBL9324308 0.83 TACR1 (0.52) TACR1
SCHEMBL8461669 0.83 TACR1 (0.52) TACR1
SCHEMBL8461665 0.83 TACR1 (0.52) TACR1
SCHEMBL9322791 0.83 TACR1 (0.52) TACR1
SCHEMBL9323071 0.82 TACR1 (0.52) TACR1
SCHEMBL9767509 0.82 TACR1 (0.52) TACR1

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
EP-0409931-B1 QUINUCLIDINE THERAPEUTIC AGENTS PFIZER (US) 1994-02-16 EP disclosed
US-5162339-A Substance P Antagonists, Gastrointestinal and Central Nervous System Disorders, Antiinflammatory Agents, Analgesics PFIZER INC. (US) 1992-11-10 US disclosed