SCHEMBL7842276

SCHEMBL7842276

Cc1ccc(Cc2ccc(C)c([N+](=O)[O-])c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ALOX12 P18054 1/20 0.52
TSHR P16473 4/20 0.51
ALDH1A1 P00352 4/20 0.51
CYP3A4 P08684 3/20 0.51
RECQL P46063 1/20 0.51
MAPT P10636 5/20 0.49
NPSR1 Q6W5P4 2/20 0.49
CYP1A2 P05177 1/20 0.49
GAA P10253 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
HSD17B10 Q99714 2/20 0.44
CES2 O00748 1/20 0.43

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
SCHEMBL17704660 0.93 ALDH1A1 (0.58) MEN1KMT2AALOX12TSHRALDH1A1
SCHEMBL10652958 0.88 CES2 (0.53) MEN1KMT2ATSHRALDH1A1CYP3A4
SCHEMBL10621310 0.88 POLB (0.53) MEN1KMT2AALOX12TSHRALDH1A1
SCHEMBL13239653 0.83 VCAM1 (0.50) MEN1KMT2ATSHRALDH1A1CYP3A4
SCHEMBL8295810 0.80 ALDH1A1 (0.56) MEN1KMT2AALOX12TSHRALDH1A1
SCHEMBL171914 0.79 TSHR (0.72) MEN1KMT2AALOX12TSHRALDH1A1
SCHEMBL29613904 0.79 TSHR (0.72) MEN1KMT2AALOX12TSHRALDH1A1
SCHEMBL715634 0.79 ALDH1A1 (0.57) MEN1KMT2AALOX12TSHRALDH1A1
SCHEMBL10662515 0.79 ALDH1A1 (0.55) MEN1KMT2AALOX12TSHRALDH1A1
SCHEMBL20707091 0.79 ALDH1A1 (0.55) MEN1KMT2AALOX12TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1150565-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION bioscience AG (DE) 2001-11-07 EP claimed
WO-2000045635-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2000-08-10 WO claimed
US-8465889-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2013-06-18 US disclosed
US-8465889-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2013-06-18 US disclosed
US-8435706-B2 2013-05-07 US disclosed
US-8435706-B2 2013-05-07 US disclosed
US-20110268472-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2011-11-03 US disclosed
US-20110268472-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2011-11-03 US disclosed