SCHEMBL3134182

SCHEMBL3134182

N=C1NC(=O)c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.74
CYP3A4 P08684 1/20 0.74
SMN1; SMN2 Q16637 1/20 0.55
PTPRC P08575 3/20 0.55
S100A4 P26447 2/20 0.55
ALDH1A1 P00352 3/20 0.54
CASP3 P42574 2/20 0.54
CAPN9 O14815 1/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
TDP2 O95551 1/20 0.54
MAPT P10636 3/20 0.52
CA9 Q16790 2/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA7 P43166 1/20 0.51
BCHE P06276 1/20 0.49
ACHE P22303 1/20 0.49
CES1 P23141 1/20 0.49
POLB P06746 1/20 0.48

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
SCHEMBL29546694 0.87 TDP1 (0.59) TDP1CYP3A4SMN1; SMN2PTPRCS100A4
SCHEMBL7816299 0.87 TDP1 (0.59) TDP1CYP3A4SMN1; SMN2PTPRCS100A4
SCHEMBL151957 0.85 CYP3A4 (1.00) TDP1CYP3A4SMN1; SMN2PTPRCS100A4
SCHEMBL27798142 0.84 CYP3A4 (0.96) TDP1CYP3A4SMN1; SMN2PTPRCS100A4
Methane SCHEMBL28326322 0.84 CYP3A4 (0.96) TDP1CYP3A4SMN1; SMN2PTPRCS100A4
SCHEMBL13083518 0.75 CAPN9 (0.71) TDP1CYP3A4PTPRCS100A4ALDH1A1
SCHEMBL7830916 0.73 TDP1 (0.47) TDP1CYP3A4SMN1; SMN2PTPRCS100A4
SCHEMBL29202832 0.72 CYP3A4 (0.71) TDP1CYP3A4SMN1; SMN2PTPRCS100A4
SCHEMBL8525627 0.72 TDP1 (0.62) TDP1CYP3A4SMN1; SMN2PTPRCS100A4
SCHEMBL27559675 0.72 CYP3A4 (0.71) TDP1CYP3A4SMN1; SMN2PTPRCS100A4

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5134189-A Isocyanate, Imino Compound, Polymeric Binder MITSUBISHI PAPER MILLS LIMITED (JP) 1992-07-28 US claimed
EP-3031611-B1 THERMAL RECORDING MATERIAL MITSUBISHI PAPER MILLS LTD (JP) 2017-09-27 EP disclosed
EP-3031611-A1 THERMAL RECORDING MATERIAL Mitsubishi Paper Mills Limited (JP) 2016-06-15 EP disclosed
US-8980790-B2 Thermosensitive multiple recording sheet and method for producing the same OJI PAPER CO., LTD. (JP) 2015-03-17 US disclosed
US-20120274059-A1 THERMOSENSITIVE MULTIPLE RECORDING SHEET AND METHOD FOR PRODUCING THE SAME OJI PAPER CO., LTD. (JP) 2012-11-01 US disclosed
US-8252138-B2 Thermosensitive multiple recording sheet and method for producing the same OJI PAPER CO., LTD. (JP) 2012-08-28 US disclosed
US-20100003467-A1 THERMOSENSITIVE MULTIPLE RECORDING SHEET AND METHOD FOR PRODUCING THE SAME OJI PAPER CO., LTD. (JP) 2010-01-07 US disclosed
US-20070104081-A1 Recording sheet OJI PAPER CO., LTD. (JP) 2007-05-10 US disclosed
US-6921740-B1 Electron-receiving compound and thermal recording material MITSUBISHI PAPER MIILS LTD. (JP) 2005-07-26 US disclosed
US-6232266-B1 COMPRISES TWO OR MORE KINDS OF COMPOUNDS, AND AT LEAST ONE OF WHICH IS FORMED A COLOR-FORMATION CONTROLLING LAYER OBTAINED BY POLYMERIZING A COMPOUND HAVING AN UNSATURATED CARBON BOND. MITSUBISHI PAPER MILLS LIMITED (JP) 2001-05-15 US disclosed
EP-0427929-A2 Heat-sensitive recording material MITSUBISHI PAPER MILLS, LTD. (JP) 1991-05-22 EP disclosed
US-4983569-A Color-forming layer comprising a fluorene dye chromogen, a developer, an isocyanate and an imino compound; infrared absorption; storage stability; colorfastness MITSUBISHI PAPER MILLS (JP) 1991-01-08 US disclosed
US-4965237-A AROMATICITY-POSESSING ISOCYANATE COMPOUND, IMINO COMPOUND, AND ANILINE DERIVATIVE MITSUBISHI PAPER MILLS, LTD. (JP) 1990-10-23 US disclosed
US-4880767-A COLOR FORMING SYSTEMS, FLUORENE DYES, DYE DEVELOPERS MITSUBISHI PAPER MILLS (JP) 1989-11-14 US disclosed
US-4824824-A COLOR FORMING AROMATIC ISOCYANATES AND IMINE COMPOUNDS MITSUBISHI PAPER MILLS, LTD. (JP) 1989-04-25 US disclosed
EP-0101741-B1 COLORING METHOD AND COLOR-FORMING MATERIAL Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1987-05-20 EP disclosed
US-4521793-A Coloring method and color-forming material ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-06-04 US disclosed
EP-0101741-A1 COLORING METHOD AND COLOR-FORMING MATERIAL Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-03-07 EP disclosed
US-4065462-A ORGANIC PIGMENTS CIBA-GEIGY CORPORATION (US) 1977-12-27 US disclosed
US-4016157-A COLORING PLASTICS AND LACQUERS CIBA-GEIGY CORPORATION (US) 1977-04-05 US disclosed