SCHEMBL11214293

SCHEMBL11214293

CC(C(=O)O)N1CCN(c2cccc(Cl)c2)CC1

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.56
HTR2A P28223 1/20 0.56
HTR7 P34969 1/20 0.56
HTR6 P50406 1/20 0.56
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA9 Q16790 1/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
LMNA P02545 1/20 0.54
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
RECQL P46063 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
RAB9A P51151 1/20 0.53
ALDH1A1 P00352 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
PANK3 Q9H999 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
SCHEMBL3693481 0.88 HTR1A (0.56) HTR1AHTR2AHTR7HTR6CA12
SCHEMBL11955707 0.86 HTR3E (0.58) HTR1AHTR2AHTR7HTR6LMNA
Hydrochloric Acid SCHEMBL9993047 0.85 CHRNA1 (0.62) CA12CA1CA9MEN1KMT2A
SCHEMBL9006342 0.84 RAD52 (0.52) MEN1KMT2ALMNATSHRNPSR1
SCHEMBL10764513 0.83 HTR1A (0.55) HTR1AHTR2AHTR7HTR6CA12
SCHEMBL6885691 0.83 KMT2A (0.61) MEN1KMT2AALDH1A1
SCHEMBL10763272 0.82 ALDH1A1 (0.57) HTR1AHTR2AHTR7HTR6MEN1
SCHEMBL4355720 0.82 ALDH1A1 (0.56) HTR1AHTR2AHTR7HTR6MEN1
SCHEMBL4255355 0.80 ALDH1A1 (0.59) HTR1AHTR2AHTR7HTR6LMNA
SCHEMBL6412443 0.79 MCOLN2 (0.60) MEN1KMT2ALMNATSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4325952-A Method of treating abstinence syndrome with cycloaklyltriazoles AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO (IT) 1982-04-20 US disclosed
US-4307095-A PSYCHOTHERAPY AND ANTIGLAUCOMA AGENTS AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 1981-12-22 US disclosed
US-4307096-A Method of treating glaucoma with cycloalkyltriazoles AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 1981-12-22 US disclosed
US-4252721-A ANTIGLAUCOMIC AND ANTIPSYCHOTIC AGENTS AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 1981-02-24 US disclosed