SCHEMBL14786285

SCHEMBL14786285

CNCC(O)(c1ccccc1)[N+](C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 4/20 0.39
CHRM2 P08172 2/20 0.39
CHRM4 P08173 2/20 0.39
CHRM5 P08912 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.39
CYP2C19 P33261 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
PABPC1 P11940 2/20 0.35
KDM4E B2RXH2 2/20 0.35
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL5142176 0.78 CYP2C19 (0.56) KCNN4CYP2C19MEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL9413960 0.76 CYP2C19 (0.54) KCNN4CHRM2CHRM4CHRM5CHRM1
SCHEMBL10156588 0.75 CYP2C19 (0.50) KCNN4CYP2C19MEN1KMT2ACYP1A2
SCHEMBL5035455 0.75 MEN1 (0.53) KCNN4CHRM2CHRM4CHRM5CHRM1
SCHEMBL3444934 0.75 KCNN4 (0.44) KCNN4CYP2C19MEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL9413928 0.74 CYP2C19 (0.53) KCNN4CHRM2CHRM4CHRM5CHRM1
SCHEMBL9413932 0.72 CYP2C19 (0.50) KCNN4CYP2C19MEN1KMT2ACYP1A2
SCHEMBL8028843 0.70 TAAR1 (0.56) KCNN4CYP2C19KDM4ELMNACYP3A4
SCHEMBL11623236 0.69 CHRM2 (0.42) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL10145455 0.69 KCNN4 (0.46) KCNN4CYP2C19MEN1KMT2ACYP2C9

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-2755629-A1 DYE COMPOSITION COMPRISING A CATIONIC PARA-AMINOPHENOL OXIDATION BASE L'OREAL (FR) 2014-07-23 EP disclosed
WO-2013037907-A1 DYE COMPOSITION COMPRISING A CATIONIC PARA-AMINOPHENOL OXIDATION BASE L'OREAL (FR) 2013-03-21 WO disclosed