SCHEMBL3129207

SCHEMBL3129207

CCOC(=O)C(C#N)=C1NC(=N)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.56
RAB9A P51151 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MAPT P10636 9/20 0.50
ALDH1A1 P00352 8/20 0.50
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
KDM4E B2RXH2 5/20 0.50
HTT P42858 4/20 0.50
LMNA P02545 3/20 0.50
TSHR P16473 1/20 0.50
HPGD P15428 5/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
NPSR1 Q6W5P4 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HIF1A Q16665 1/20 0.47
PKM P14618 2/20 0.46

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
SCHEMBL3129203 1.00 MAPK1 (0.56) MAPK1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL3139922 0.85 IDO1 (0.54) MAPK1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL11207973 0.85 IDO1 (0.54) MAPK1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL11207971 0.85 IDO1 (0.54) MAPK1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL23171281 0.77 HPGD (0.44) MAPK1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL10632150 0.77 HPGD (0.44) MAPK1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL29774549 0.77 MAPK1 (0.51) MAPK1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL29774542 0.77 MAPK1 (0.51) MAPK1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL3144556 0.75 ALDH1A1 (0.47) MAPK1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL3144562 0.75 ALDH1A1 (0.47) MAPK1RAB9AL3MBTL1MAPTALDH1A1

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 31 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
US-5043315-A Aromatic or heterocyclic isocyanate and imino compound MITSUBISHI PAPER MILLS LIMITED (JP) 1991-08-27 US disclosed
EP-0439638-A1 Heat sensitive recording material MITSUBISHI PAPER MILLS, LTD. (JP) 1991-08-07 EP disclosed
US-5036039-A Aromatic isocyanate and imine MITSUBISHI PAPER MILLS LIMITED (JP) 1991-07-30 US 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