SCHEMBL9404693

SCHEMBL9404693

C=C(C)C(=O)OCCc1ccccc1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.48
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 5/20 0.45
TSHR P16473 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PTPN1 P18031 1/20 0.44
CYP2C19 P33261 2/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
HTT P42858 1/20 0.43
HPGD P15428 1/20 0.42
THRB P10828 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
SCHEMBL11025540 0.92 MAOB (0.46) MAOBMEN1KMT2ANPC1RAB9A
SCHEMBL11025521 0.89 MAOB (0.41) MAOBMEN1KMT2ANPC1RAB9A
SCHEMBL13627799 0.88 MAOB (0.49) MAOBMEN1KMT2ANPC1RAB9A
SCHEMBL719824 0.87 MAOB (0.56) MAOBMEN1KMT2ANPC1RAB9A
SCHEMBL11029071 0.86 THRB (0.41) MAOBNPC1RAB9AALDH1A1TSHR
SCHEMBL7421292 0.85 MAOB (0.52) MAOBMEN1KMT2ANPC1RAB9A
SCHEMBL11023135 0.85 ALDH1A1 (0.47) MEN1KMT2ASMN1; SMN2ALDH1A1TSHR
SCHEMBL11028007 0.84 THRB (0.42) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL11026162 0.82 ALDH1A1 (0.56) MEN1KMT2ASMN1; SMN2ALDH1A1TSHR
SCHEMBL11029438 0.82 THRB (0.39) MAOBSMN1; SMN2ALDH1A1TSHRPOLB

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
EP-0406849-B1 Electron-conductive high polymer and electroconductive material having the same FUJI PHOTO FILM CO LTD (JP) 1994-10-05 EP disclosed
US-5243004-A Polymeric conductors FUJI PHOTO FILM CO., LTD. (JP) 1993-09-07 US disclosed
US-5115057-A Polymers for electronics with antistatic properties as molding materials FUJI PHOTO FILM CO., LTD. (JP) 1992-05-19 US disclosed
EP-0406849-A2 Electron-conductive high polymer and electroconductive material having the same Fuji Photo Film Co., Ltd. (JP) 1991-01-09 EP disclosed
EP-0067954-B1 ORGANIC PHOTOCONDUCTIVE COMPOSITIONS FOR ELECTROPHOTOGRAPHY KABUSHIKI KAISHA TOSHIBA (JP) 1985-08-28 EP disclosed
EP-0067954-A2 Organic photoconductive compositions for electrophotography KABUSHIKI KAISHA TOSHIBA (JP) 1982-12-29 EP disclosed