SCHEMBL769417

SCHEMBL769417

N#Cc1cccc(Cl)c1C#N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 3/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
DYRK1A Q13627 2/20 0.46
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.40
HIF1A Q16665 1/20 0.40
TSHR P16473 1/20 0.39
GRIA1 P42261 1/20 0.39
CACNG8 Q8WXS5 1/20 0.39
TRPV4 Q9HBA0 1/20 0.39
GAA P10253 2/20 0.38
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
CA1 P00915 1/20 0.36

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
SCHEMBL30539289 1.00 KDM4E (0.53) KDM4EALDH1A1L3MBTL1DYRK1ACYP1A2
Dichlobenil SCHEMBL55606 0.85 ALDH1A1 (0.55) KDM4EALDH1A1L3MBTL1DYRK1ACYP1A2
Dichlobenil SCHEMBL1701380 0.85 ALDH1A1 (0.55) KDM4EALDH1A1L3MBTL1DYRK1ACYP1A2
SCHEMBL16951210 0.85 KDM4E (0.44) KDM4EALDH1A1L3MBTL1DYRK1ACYP1A2
Dichlobenil SCHEMBL10737856 0.82 ALDH1A1 (0.53) KDM4EALDH1A1L3MBTL1DYRK1ACYP1A2
Dichlobenil SCHEMBL28232070 0.82 ALDH1A1 (0.53) KDM4EALDH1A1L3MBTL1DYRK1ACYP1A2
SCHEMBL645262 0.82 TSHR (0.48) KDM4EALDH1A1L3MBTL1CYP1A2CYP3A4
Dichlobenil SCHEMBL10741379 0.80 ALDH1A1 (0.52) KDM4EALDH1A1L3MBTL1DYRK1ACYP1A2
SCHEMBL101977 0.78 DYRK1A (0.47) KDM4EALDH1A1L3MBTL1DYRK1ACYP1A2
SCHEMBL27895311 0.78 DYRK1A (0.47) KDM4EALDH1A1L3MBTL1DYRK1ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114195964-B Low-melting-point self-catalyzed curing resin oligomer, curing material and preparation method thereof 中钢集团鞍山热能研究院有限公司 2023-05-26 CN claimed
CN-105418468-B Synthetic method for quinone aryl thioether compounds 深圳拒马科技有限公司 2017-03-22 CN claimed
CN-101693694-A Preparation method of glyoxaline formic ether and derivative thereof SUZHOU CHIREACH BIOMEDICAL TEC 2010-04-14 CN claimed
CN-113801122-B Method for preparing phthalocyanine green and phthalocyanine green 鞍山七彩化学股份有限公司 2023-09-01 CN disclosed
CN-114195964-B Low-melting-point self-catalyzed curing resin oligomer, curing material and preparation method thereof 中钢集团鞍山热能研究院有限公司 2023-05-26 CN disclosed
CN-113767898-B Fertilizer and agrochemical formulations 三井化学AGRO株式会社 2023-01-17 CN disclosed
CN-111004149-B Method for preparing polyfluorobenzonitrile by catalytic fluorination of polychlorinated benzonitrile 大连奇凯医药科技有限公司 2022-06-07 CN disclosed
EP-3211042-B1 PHTHALOCYANINE SYNTHESIS SUN CHEMICAL CORP (US) 2019-06-26 EP disclosed
CN-109913203-A Chromophoric polymers point with narrow emission 华盛顿大学商业中心 2019-06-21 CN disclosed
CN-109564714-A Alarm glass panel assembly 法国圣戈班玻璃厂 2019-04-02 CN disclosed
CN-108689924-A 4-amino-6- (4-substituted phenyl) -pyridine-2-carboxylic acid esters and their use as herbicides 美国陶氏益农公司 2018-10-23 CN disclosed
WO-1987007267-A1 METHOD OF SYNTHESIZING TETRAFLUOROPHTHALONITRILE ALLIED CORPORATION (US) 1987-12-03 WO disclosed
US-4684734-A Method for manufacture or organic fluorine compounds NIPPON SHOKUBAI KK CO., LTD. (JP) 1987-08-04 US disclosed
US-4485050-A Process for the continuous production of tetrachlorophthalonitrile in a fluidized bed reactor CAFFARO S.P.A. (IT) 1984-11-27 US disclosed
EP-0120575-A1 Organic fluorine compounds Nippon Shokubai Kagaku Kogyo Co., Ltd (JP) 1984-10-03 EP disclosed
EP-0042531-B1 ISOINDOLINE DERIVATIVES AND THEIR USES AS INTERMEDIATES IN THE PREPARATION OF DYESTUFFS BAYER AG (DE) 1984-02-08 EP disclosed
EP-0042531-A1 Isoindoline derivatives and their uses as intermediates in the preparation of dyestuffs BAYER AG (DE) 1981-12-30 EP disclosed
US-4297283-A HEATING WITH A GASEOUS MIXTURE OF CHLORINE AND INERT GAS TO OBTAIN 4-CHLOROPHTHALIC ANHYDRIDE GENERAL ELECTRIC COMPANY (US) 1981-10-27 US disclosed
US-4239686-A Process for producing phthalimido derivatives ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1980-12-16 US disclosed
US-3994921-A COLORING PLASTICS AND LACQUERS YELLOW CIBA-GEIGY CORPORATION (US) 1976-11-30 US disclosed