SCHEMBL2927708

SCHEMBL2927708

CCCCCCCCCCCC(Br)N1C=Cc2ccccc2C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
HDAC3 O15379 1/20 0.36
NAMPT P43490 4/20 0.35
SETD7 Q8WTS6 1/20 0.33
NPC1 O15118 1/20 0.32
MITF O75030 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31
OPRL1 P41146 1/20 0.31
CSNK1E P49674 1/20 0.31

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
SCHEMBL9379343 0.78 HDAC3 (0.39) ALDH1A1CYP1A2CYP2D6CYP2C19HDAC3
SCHEMBL2333230 0.76 HDAC3 (0.39) ALDH1A1CYP1A2CYP2D6CYP2C19HDAC3
Bromide SCHEMBL8943709 0.74 HDAC3 (0.60) ALDH1A1CYP1A2CYP2D6CYP2C19HDAC3
Bromide SCHEMBL1961823 0.74 HDAC3 (0.60) ALDH1A1CYP1A2CYP2D6CYP2C19HDAC3
SCHEMBL1961830 0.73 HDAC3 (0.61) ALDH1A1CYP1A2CYP2D6CYP2C19HDAC3
SCHEMBL9512254 0.73 HDAC3 (0.61) ALDH1A1CYP1A2CYP2D6CYP2C19HDAC3
SCHEMBL1959030 0.73 HDAC3 (0.61) ALDH1A1CYP1A2CYP2D6CYP2C19HDAC3
SCHEMBL1963183 0.73 HDAC3 (0.61) ALDH1A1CYP1A2CYP2D6CYP2C19HDAC3
SCHEMBL1963055 0.73 HDAC3 (0.61) ALDH1A1CYP1A2CYP2D6CYP2C19HDAC3
SCHEMBL9809180 0.72 MEN1 (0.37) ALDH1A1CYP1A2CYP2D6CYP2C19HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100263135-A1 PROCESS FOR PERMANENT BODY EPILATION FONTANI PAOLA 2010-10-21 US disclosed
EP-2227217-A2 PROCESS FOR PERMANENT BODY EPILATION Fontani, Paola (IT) 2010-09-15 EP disclosed
WO-2009086973-A2 PROCESS FOR PERMANENT BODY EPILATION FONTANI PAOLA (IT) 2009-07-16 WO disclosed