SCHEMBL7005231

SCHEMBL7005231

C(=C(c1ccc(-c2ccc(C(=Cc3ccccc3)N(c3ccccc3)c3ccccc3)cc2)cc1)N(c1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.44
ESR1 P03372 1/20 0.40
TP53 P04637 1/20 0.39
ALDH1A1 P00352 5/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
MAPT P10636 3/20 0.38
HPGD P15428 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
GAA P10253 1/20 0.38
POLB P06746 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
HTT P42858 1/20 0.36
AKR1C1 Q04828 1/20 0.36
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
PTPN1 P18031 1/20 0.35
GSK3B P49841 1/20 0.35

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
SCHEMBL2299170 0.94 TRPM8 (0.48) TRPM8ESR1ALDH1A1KMT2AMEN1
SCHEMBL6031703 0.90 TRPM8 (0.48) TRPM8ESR1ALDH1A1KMT2AMEN1
SCHEMBL9446234 0.90 TRPM8 (0.48) TRPM8ESR1ALDH1A1KMT2AMEN1
SCHEMBL9446229 0.90 TRPM8 (0.48) TRPM8ESR1ALDH1A1KMT2AMEN1
SCHEMBL9473182 0.82 NPC1 (0.47) TRPM8ESR1ALDH1A1KMT2AMEN1
SCHEMBL9240058 0.80 ALDH1A1 (0.41) TRPM8ALDH1A1KMT2AMEN1MAPT
SCHEMBL8722435 0.79 CYP1B1 (0.51) ALDH1A1KMT2AMEN1MAPTL3MBTL1
SCHEMBL9478783 0.79 TRPM8 (0.47) TRPM8ALDH1A1KMT2AMEN1MAPT
SCHEMBL2451140 0.77 ALDH1A1 (0.34) TRPM8ALDH1A1KMT2AMEN1MAPT
SCHEMBL22263615 0.77 TRPM8 (0.54) TRPM8ALDH1A1KMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113939872-B Optical system and optical method 上海必修福企业管理有限公司 2024-01-30 CN disclosed
EP-0847228-B1 Material for organoelectroluminescence device and use thereof TOYO INK MFG CO (JP) 2003-04-16 EP disclosed
EP-1191020-A2 Material for organic electroluminescence device and use thereof TOYO INK MANUFACTURING CO., LTD. (JP) 2002-03-27 EP disclosed
US-6245449-B1 LIGHT EMITTER LAYERS OR ORGANIC COMPOUNDS, THIN LAYERS AND ELECTRODES, ANODES AND CATHODES TOYO INK MANUFACTURING CO., LTD. (JP) 2001-06-12 US disclosed
US-6150042-A ELECTROLUMINESCENCE DEVICE WITH HOLE INJECTING MATERIAL HAVING GOOD DURABILITY BEING A TRIPHENYLENE STRUCTURE OF GIVEN FORMULA HAVING MULTIPLE ETHER, SULFIDE, AND/OR AMINE SUBSTITUTIONS TOYO INK MANUFACTURING CO., LTD. (JP) 2000-11-21 US disclosed
EP-0847228-A2 Material for organoelectroluminescence device and use thereof TOYO INK MANUFACTURING CO., LTD. (JP) 1998-06-10 EP disclosed