SCHEMBL7328353

SCHEMBL7328353

OC(c1ccccc1)(c1ccc(F)cc1)C1CCNCC1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.81
MEN1 O00255 1/20 0.81
LMNA P02545 1/20 0.81
HRH1 P35367 1/20 0.81
SCN1A P35498 1/20 0.81
KMT2A Q03164 1/20 0.81
SCN2A Q99250 1/20 0.81
SCN3A Q9NY46 1/20 0.81
CYP19A1 P11511 1/20 0.53
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
CYP1A2 P05177 1/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
CYP2C19 P33261 1/20 0.44
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 1/20 0.43
CHRM3 P20309 1/20 0.43
NPY2R P49146 2/20 0.42
ATM Q13315 1/20 0.41

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
SCHEMBL2306732 0.93 MEN1 (0.68) CYP2D6MEN1LMNAHRH1SCN1A
Hydrochloric Acid SCHEMBL7442875 0.92 CYP2D6 (0.66) CYP2D6MEN1LMNAHRH1SCN1A
Hydrochloric Acid SCHEMBL10459095 0.90 CYP2D6 (0.64) CYP2D6MEN1LMNAHRH1SCN1A
Azacyclonol SCHEMBL241817 0.90 HRH1 (1.00) CYP2D6MEN1LMNAHRH1SCN1A
Azacyclonol SCHEMBL6135637 0.88 HRH1 (0.96) CYP2D6MEN1LMNAHRH1SCN1A
Azacyclonol SCHEMBL1890138 0.88 HRH1 (0.96) CYP2D6MEN1LMNAHRH1SCN1A
Azacyclonol SCHEMBL1648657 0.86 HRH1 (0.93) CYP2D6MEN1LMNAHRH1SCN1A
SCHEMBL11395372 0.85 CYP2D6 (0.83) CYP2D6MEN1LMNAHRH1SCN1A
SCHEMBL11832155 0.84 CYP2D6 (0.81) CYP2D6MEN1LMNAHRH1SCN1A
SCHEMBL11831606 0.84 HRH1 (0.81) CYP2D6MEN1LMNAHRH1SCN1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1058780-A Has the active thiazolidine carboxylic acid amides derivative of anti-allergy, their preparation and application SANKYO CO (JP) 1992-02-19 CN claimed
CN-1058780-A Has the active thiazolidine carboxylic acid amides derivative of anti-allergy, their preparation and application SANKYO CO (JP) 1992-02-19 CN disclosed
US-5070087-A Aryl(alkyland alkylene)-N-((phenoxy and phenylthio)alkyl) aminoheterocyclics as cardiovascular, anthihistaminic, antisecretory and antiallergy agents A. H. ROBINS COMPANY, INCORPORATED (US) 1991-12-03 US disclosed
US-5063235-A 4-[(diaryl)hydromethyl]-1-piperidinealkanols and esters and carbamates thereof useful in the treatment of allergic disorders A. H. ROBINS COMPANY, INC. (US) 1991-11-05 US disclosed
US-5057524-A Asthma, dermatitis A. H. ROBINS COMPANY INCORPORATED (US) 1991-10-15 US disclosed
US-4950674-A Arylalkylheterocyclic amines,N-substituted by aryloxyalkyl group in a method for allergy treatment A. H. ROBINS COMPANY, INCORPORATED (US) 1990-08-21 US disclosed
US-4886794-A ANTIHISTAMINES, ANTIALLERGENS A. H. ROBINS COMPANY, INCORPORATED (US) 1989-12-12 US disclosed
US-4810713-A Arylalkyl-heterocyclic amines, n-substituted by aryloxyalkyl groups used in a method for allergy treatment A. H. ROBINS COMPANY, INCORPORATED (US) 1989-03-07 US disclosed
EP-0291244-A1 Cyclic carbamate derivatives A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1988-11-17 EP disclosed
EP-0235463-A2 N-substituted-arylalkyl and arylalkylene piperidines as cardiovascular antihistaminic and antisecretory agents A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1987-09-09 EP disclosed
US-4032642-A SEDATIVES, TRANQUILIZERS A. H. ROBINS COMPANY, INCORPORATED (US) 1977-06-28 US disclosed
US-3956296-A ANTIINFLAMMATORY, SEDATIVES, TRANQUILIZERS A. H. ROBINS COMPANY, INCORPORATED (US) 1976-05-11 US disclosed