SCHEMBL8500210

SCHEMBL8500210

Cc1ccc(CCCN)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.52
TAAR1 Q96RJ0 1/20 0.52
SIGMAR1 Q99720 4/20 0.47
CYP3A4 P08684 1/20 0.45
GLA P06280 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
SKP2 Q13309 1/20 0.42
IGF1R P08069 1/20 0.41
ALOX15 P16050 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
STK17A Q9UEE5 2/20 0.38
STK17B O94768 1/20 0.38

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
SCHEMBL17186331 0.88 TAAR1 (0.67) PNMTTAAR1SIGMAR1CYP3A4GLA
SCHEMBL12719081 0.82 SKP2 (0.56) SIGMAR1CYP3A4GLASMN1; SMN2NPSR1
SCHEMBL5146820 0.82 SKP2 (0.50) TAAR1ALDH1A1SKP2CYP1A2CYP2D6
SCHEMBL4037320 0.82 PNMT (0.76) PNMTTAAR1SIGMAR1ALDH1A1IGF1R
SCHEMBL80740 0.81 SKP2 (0.42) PNMTTAAR1SIGMAR1CYP3A4ALDH1A1
SCHEMBL82284 0.81 IGF1R (0.44) PNMTTAAR1SIGMAR1CYP3A4ALDH1A1
Hydrochloric Acid SCHEMBL14829816 0.80 PNMT (0.73) PNMTTAAR1SIGMAR1CYP3A4GLA
Hydrochloric Acid SCHEMBL5146884 0.80 SKP2 (0.48) TAAR1GLAALDH1A1SKP2CYP1A2
SCHEMBL109221 0.79 CYP3A4 (0.52) PNMTTAAR1CYP3A4ALDH1A1NPSR1
SCHEMBL29487211 0.79 CYP3A4 (0.52) PNMTTAAR1CYP3A4ALDH1A1NPSR1

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-0735018-B1 N-(alpha-alkylbenzylidene)-alpha-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL CO (JP) 1999-07-21 EP disclosed
EP-0735018-A1 N-(alpha-alkylbenzylidene)-alpha-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-02 EP disclosed