SCHEMBL9446229

SCHEMBL9446229

C(=C(\c1ccccc1)N(c1ccccc1)c1ccccc1)\c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.48
ALDH1A1 P00352 7/20 0.47
MAPT P10636 4/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
HPGD P15428 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
GAA P10253 1/20 0.47
AKR1C1 Q04828 1/20 0.44
NPSR1 Q6W5P4 2/20 0.41
PRMT1 Q99873 1/20 0.40
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
POLB P06746 2/20 0.39
HTT P42858 2/20 0.39
ESR1 P03372 1/20 0.39
MTNR1A P48039 2/20 0.39
MTNR1B P49286 2/20 0.39
CYP19A1 P11511 1/20 0.38
CYP11B2 P19099 1/20 0.38

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
SCHEMBL9446234 1.00 TRPM8 (0.48) TRPM8ALDH1A1MAPTKMT2AMEN1
SCHEMBL6031703 1.00 TRPM8 (0.48) TRPM8ALDH1A1MAPTKMT2AMEN1
SCHEMBL2299170 0.96 TRPM8 (0.48) TRPM8ALDH1A1MAPTKMT2AMEN1
SCHEMBL7005231 0.90 TRPM8 (0.44) TRPM8ALDH1A1MAPTKMT2AMEN1
SCHEMBL9240058 0.89 ALDH1A1 (0.41) TRPM8ALDH1A1MAPTKMT2AMEN1
SCHEMBL9478783 0.87 TRPM8 (0.47) TRPM8ALDH1A1MAPTKMT2AMEN1
SCHEMBL9473182 0.83 NPC1 (0.47) TRPM8ALDH1A1MAPTKMT2AMEN1
SCHEMBL11969933 0.81 L3MBTL1 (0.45) TRPM8ALDH1A1MAPTKMT2AMEN1
SCHEMBL8722435 0.81 CYP1B1 (0.51) ALDH1A1MAPTKMT2AMEN1L3MBTL1
SCHEMBL28947692 0.81 TRPM8 (0.44) TRPM8ALDH1A1MAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1811585-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Idemitsu Kosan Co., Ltd. (JP) 2007-07-25 EP disclosed
US-5196606-A Aromatic tertiary amines, enamines, deoxybenzoins and benzils HAY ALLAN S (CA) 1993-03-23 US disclosed
US-5117062-A Aromatic tertiary amines, enamines, deoxybenzoins and benzils HAY ALLAN S (CA) 1992-05-26 US disclosed
US-5011998-A Aromatic tertiary amines, enamines, deoxybenzoins and benzils HAY ALLAN S (CA) 1991-04-30 US disclosed