SCHEMBL7266294

SCHEMBL7266294

CCc1cc2c(s1)CCN(Cc1ccccc1Cl)C2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 5/20 0.62
ALDH1A1 P00352 4/20 0.62
DRD4 P21917 4/20 0.62
KCNH2 Q12809 3/20 0.62
CYP2C19 P33261 2/20 0.62
SIGMAR1 Q99720 2/20 0.62
USP2 O75604 1/20 0.62
ABCB11 O95342 1/20 0.62
LMNA P02545 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
ADRA2A P08913 1/20 0.62
ADORA3 P0DMS8 1/20 0.62
CYP2D6 P10635 1/20 0.62
CYP2C9 P11712 1/20 0.62
ADRB3 P13945 1/20 0.62
ADRA2B P18089 1/20 0.62
ADRA2C P18825 1/20 0.62
CYP2B6 P20813 1/20 0.62
DRD1 P21728 1/20 0.62

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
SCHEMBL18885264 0.85 DRD3 (0.56) DRD3ALDH1A1DRD4KCNH2CYP2C19
SCHEMBL19559070 0.83 DRD3 (0.59) DRD3ALDH1A1DRD4KCNH2CYP2C19
SCHEMBL17504844 0.82 ALDH1A1 (0.58) DRD3ALDH1A1DRD4KCNH2CYP2C19
SCHEMBL17504856 0.82 DRD3 (0.58) DRD3ALDH1A1DRD4KCNH2CYP2C19
SCHEMBL19557305 0.82 DRD3 (0.58) DRD3ALDH1A1DRD4KCNH2CYP2C19
SCHEMBL19559030 0.82 DRD3 (0.58) DRD3ALDH1A1DRD4KCNH2CYP2C19
SCHEMBL29509298 0.82 ALDH1A1 (0.58) DRD3ALDH1A1DRD4KCNH2CYP2C19
SCHEMBL29509158 0.82 DRD3 (0.58) DRD3ALDH1A1DRD4KCNH2CYP2C19
SCHEMBL17506581 0.81 DRD3 (0.56) DRD3ALDH1A1DRD4KCNH2CYP2C19
SCHEMBL17558849 0.81 DRD3 (0.56) DRD3ALDH1A1DRD4KCNH2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0302793-B1 Aralkylaminoalkoxyphenyl derivatives, process of preparation and compositions containing the same SANOFI ELF (FR) 1993-12-15 EP disclosed
US-5215988-A Treating angina, hypertension, arrhythmia, cerebral vascular insufficiency SANOFI (FR) 1993-06-01 US disclosed
US-5147878-A Hypotensive, antiarrhythmia agents SANOFI (FR) 1992-09-15 US disclosed
US-5017579-A Use of aminoalkoxyphenyl derivatives for reducing and/or controlling excessive intraocular pressure SANOFI (FR) 1991-05-21 US disclosed
US-4994474-A Hypotensive agents SANOFI (FR) 1991-02-19 US disclosed
EP-0302792-A2 Alkylaminoalkoxyphenyl derivatives, process of preparation and compositions containing the same SANOFI (FR) 1989-02-08 EP disclosed
EP-0302793-A2 Aralkylaminoalkoxyphenyl derivatives, process of preparation and compositions containing the same ELF SANOFI (FR) 1989-02-08 EP disclosed