SCHEMBL8218323

SCHEMBL8218323

Nc1ccc(C(O)(c2ccccc2)c2ccc(N)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
CYP3A4 P08684 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
TAAR1 Q96RJ0 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYP19A1 P11511 5/20 0.46
CYP1A2 P05177 3/20 0.43
CYP2C9 P11712 3/20 0.43
CYP2C19 P33261 3/20 0.43
KCNN4 O15554 1/20 0.42
MAPT P10636 5/20 0.41
MAOA P21397 4/20 0.41
MAOB P27338 3/20 0.41
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HTT P42858 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP2D6 P10635 1/20 0.41

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
Aniline SCHEMBL5862814 0.95 TSHR (0.55) TSHRCYP3A4TDP1TAAR1HSD17B10
SCHEMBL301882 0.89 MAPT (0.50) TSHRCYP3A4TDP1HSD17B10CYP19A1
SCHEMBL9050608 0.87 CYP19A1 (0.54) TSHRCYP3A4HSD17B10CYP19A1CYP1A2
Triphenylmethanol SCHEMBL1332873 0.84 CYP19A1 (0.50) TSHRCYP3A4HSD17B10CYP19A1CYP1A2
Triphenylmethanol SCHEMBL700 0.84 CYP19A1 (0.50) TSHRCYP3A4HSD17B10CYP19A1CYP1A2
Triphenylmethanol SCHEMBL456603 0.84 CYP19A1 (0.50) TSHRCYP3A4HSD17B10CYP19A1CYP1A2
SCHEMBL1899103 0.81 CYP3A4 (0.55) TSHRCYP3A4TDP1HSD17B10CYP19A1
SCHEMBL11941126 0.81 KMT2A (0.48) TSHRCYP3A4TDP1TAAR1HSD17B10
Triphenylmethanol SCHEMBL1565321 0.81 CYP19A1 (0.48) TSHRCYP3A4HSD17B10CYP19A1CYP1A2
Triphenylmethanol SCHEMBL29446231 0.81 CYP19A1 (0.48) TSHRCYP3A4HSD17B10CYP19A1CYP1A2

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-6024895-A COMPRISING SOLUBLE, ELECTRICALLY CONDUCTING POLYMER HAVING SULFONIC ACID GROUP AND/OR CARBOXYL GROUP AND THERMALLY CROSS-LINKABLE OR ULTRAVIOLET- OR ELECTRON BEAM-CROSS-LINKABLE RESIN OR PAINT MITSUBISHI RAYON CO., LTD. (JP) 2000-02-15 US disclosed
EP-0844284-A1 CROSS-LINKABLE CONDUCTIVE COMPOSITION, CONDUCTOR, AND PROCESS FOR FORMING THE SAME NITTO CHEMICAL INDUSTRY CO., LTD. (JP) 1998-05-27 EP disclosed
EP-0837112-A2 Cross-linkable, electrically conductive composition, electric conductor and process for forming the same NITTO CHEMICAL INDUSTRY CO., LTD. (JP) 1998-04-22 EP disclosed