SCHEMBL14948484

SCHEMBL14948484

BrCc1cccc(N(c2ccc(Br)cc2)c2ccc(Br)cc2)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.38
ALDH1A1 P00352 3/20 0.37
TSHR P16473 3/20 0.37
TRPA1 O75762 1/20 0.37
CYP1A2 P05177 1/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 1/20 0.35
PYCR1 P32322 3/20 0.34
HTT P42858 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TAAR1 Q96RJ0 2/20 0.33
CNR2 P34972 1/20 0.33
CYP19A1 P11511 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
MAOB P27338 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
SCHEMBL14948464 0.87 TAAR1 (0.42) SIGMAR1ALDH1A1TSHRTRPA1PYCR1
SCHEMBL14948466 0.86 TSHR (0.52) SIGMAR1ALDH1A1TSHRTRPA1CYP1A2
SCHEMBL14948434 0.84 CYP2C19 (0.46) ALDH1A1TSHRTRPA1HTTCNR2
SCHEMBL12922778 0.84 ALDH1A1 (0.45) SIGMAR1ALDH1A1TSHRTRPA1CYP1A2
SCHEMBL26965501 0.82 CALM1 (0.41) SIGMAR1ALDH1A1TSHRCYP1A2MAPK1
SCHEMBL14948455 0.80 ALDH1A1 (0.41) ALDH1A1TSHRTRPA1KDM4EPYCR1
SCHEMBL14948406 0.80 KDM4E (0.40) SIGMAR1ALDH1A1TSHRKDM4EHTT
SCHEMBL29591313 0.78 ALDH1A1 (0.48) ALDH1A1TSHRCYP1A2MAPK1KDM4E
SCHEMBL22698927 0.76 AGXT (0.41) ALDH1A1TSHRTRPA1CYP1A2KDM4E
SCHEMBL18682086 0.76 RAB9A (0.44) ALDH1A1TSHRTRPA1HTTCNR2

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
US-9184388-B2 Layered structure, electronic device using same, aromatic compound, and method for manufacturing said compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-11-10 US disclosed
US-20130119369-A1 LAYERED STRUCTURE, ELECTRONIC DEVICE USING SAME, AROMATIC COMPOUND, AND METHOD FOR MANUFACTURING SAID COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-05-16 US disclosed