SCHEMBL1019709

SCHEMBL1019709

O=C=Nc1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
ALDH1A1 P00352 6/20 0.39
TSHR P16473 4/20 0.36
HSD17B10 Q99714 3/20 0.36
RECQL P46063 2/20 0.36
CYP3A4 P08684 1/20 0.36
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
AHR P35869 1/20 0.32
HPGD P15428 1/20 0.32
CA9 Q16790 2/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
AKR1C4 P17516 1/20 0.31
AKR1C3 P42330 1/20 0.31

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
SCHEMBL8678915 0.86 MAPK1 (0.44) MAPK1TDP1GABRA1GABRB2ALDH1A1
SCHEMBL9834243 0.85 MAPK1 (0.38) MAPK1TDP1GABRA1GABRB2ALDH1A1
SCHEMBL9835832 0.85 MAPK1 (0.38) MAPK1TDP1GABRA1GABRB2ALDH1A1
SCHEMBL10882218 0.83 GABRA1 (0.41) MAPK1TDP1GABRA1GABRB2ALDH1A1
SCHEMBL5206535 0.83 MAPK1 (0.59) MAPK1TDP1GABRA1GABRB2TSHR
SCHEMBL10614846 0.82 GABRA1 (0.53) MAPK1TDP1GABRA1GABRB2ALDH1A1
SCHEMBL11341535 0.82 MAPK1 (0.36) MAPK1TDP1GABRA1GABRB2ALDH1A1
SCHEMBL6330610 0.81 MAPK1 (0.42) MAPK1TDP1GABRA1GABRB2
SCHEMBL1950823 0.81 MAPK1 (0.42) MAPK1TDP1GABRA1GABRB2
SCHEMBL11322087 0.81 GABRA1 (0.42) MAPK1TDP1GABRA1GABRB2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106892893-B Method for preparing lactide from lactic acid oligomer 中国科学院长春应用化学研究所 2020-09-25 CN claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
EP-4713378-A1 ESTERIFIED ETHANOLAMINES FOR PREPARING ISOCYANURATE POLYMERS Covestro Deutschland AG (DE) 2026-03-25 EP disclosed
EP-3774961-B1 ADDUCTS OF AMINE CATALYSTS FOR PRODUCING ISOCYANURATE POLYMERS COVESTRO DEUTSCHLAND AG (DE) 2025-01-15 EP disclosed
WO-2024236000-A1 ESTERIFIED ETHANOLAMINES FOR PREPARING ISOCYANURATE POLYMERS COVESTRO DEUTSCHLAND AG (DE) 2024-11-21 WO disclosed
EP-4464727-A1 ESTERIFIED ETHANOLAMINES FOR THE PREPARATION OF ISOCYANURATE POLYMERS Covestro Deutschland AG (DE) 2024-11-20 EP disclosed
CN-116239551-B Furanylurea compound with molluscicidal activity and preparation and application thereof 湖北大学 2024-07-26 CN disclosed
US-20240150515-A1 Low Viscosity Catalyst Compositions for Producing Isocyanurate Polymers COVESTRO DEUTSCHLAND AG (DE) 2024-05-09 US disclosed
EP-4298140-A1 LOW VISCOSITY CATALYST COMPOSITIONS FOR PRODUCING ISOCYANURATE POLYMERS Covestro Deutschland AG (DE) 2024-01-03 EP disclosed
CN-116917364-A Low viscosity catalyst composition for producing isocyanurate polymers 科思创德国股份有限公司 2023-10-20 CN disclosed
CN-116239551-A Furanylurea compound with molluscicidal activity and preparation and application thereof 湖北大学 2023-06-09 CN disclosed
US-4521793-A Coloring method and color-forming material ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-06-04 US disclosed
US-4518761-A Process for the preparation of mixed trimers from organic isocyanates, the mixed trimers obtained according to the process and the use thereof for the production of polyurethanes BAYER AKTIENGESELLSCHAFT (DE) 1985-05-21 US disclosed
US-4477389-A Polyhalogenated phenyl isocyanate synthesis with excess phosgene and either triethylamine or tetramethylurea THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1984-10-16 US disclosed
EP-0101741-A1 COLORING METHOD AND COLOR-FORMING MATERIAL Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-03-07 EP disclosed
EP-0078991-A2 Process for the preparation of mixed trimers of organic isocyanates, mixed trimers obtained by this process and their use in the preparation of polyurethanes BAYER AG (DE) 1983-05-18 EP disclosed
US-4267070-A Catalyst for the synthesis of aromatic monoisocyanates NEFEDOV BORIS K 1981-05-12 US disclosed
US-4046909-A Pyrrolidylidene, piperidylidene and hexahydroazepinylidene ureas as CNS depressants MCNEIL LABORATORIES, INCORPORATED (US) 1977-09-06 US disclosed
US-3998958-A Pyrrolidylidene, piperidylidene and hexahydroazepinylidene ureas as CNS depressants MCNEIL LABORATORIES, INCORPORATED (US) 1976-12-21 US disclosed
US-3961061-A INSECTICIDES, FUNGICIDES, BACTERICIDES, MITICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-06-01 US disclosed