SCHEMBL3286452

SCHEMBL3286452

C1=NCCN1Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.48
MC4R P32245 1/20 0.41
CYP19A1 P11511 1/20 0.41
DRD4 P21917 1/20 0.40
GAA P10253 1/20 0.40
GFER P55789 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
ACHE P22303 1/20 0.39
CYP3A4 P08684 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CCR3 P51677 1/20 0.38

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
Hydrochloric Acid SCHEMBL17968381 0.98 SIGMAR1 (0.47) SIGMAR1MC4RCYP19A1DRD4GAA
SCHEMBL28791910 0.86 SIGMAR1 (0.39) SIGMAR1MC4RCYP19A1DRD4GAA
SCHEMBL14045337 0.81 ALDH1A1 (0.47) SIGMAR1GFERLMNACYP3A4
SCHEMBL5778051 0.81 SLC6A3 (0.48) SIGMAR1ACHECCR3
Hydrochloric Acid SCHEMBL11349399 0.79 SLC6A3 (0.47) SIGMAR1ACHE
(Chloromethyl)Benzene SCHEMBL29290955 0.76 APOBEC3G (0.35) SIGMAR1GAALMNAPOLBCYP3A4
SCHEMBL9447183 0.74 KDM4E (0.35) CYP19A1LMNA
SCHEMBL14045402 0.74 KDM4E (0.51) CYP19A1LMNAPOLB
SCHEMBL3855347 0.74 SLC6A4 (0.44)
Hydrochloric Acid SCHEMBL284912 0.73 SLC6A4 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109678800-B Benzyl imidazoline cationic compound, corrosion inhibitor, preparation method and application 中国科学院理化技术研究所 2021-04-02 CN claimed
CN-109942493-B Oil-based thioamido benzyl imidazoline cationic compound, preparation thereof, corrosion inhibitor containing cationic compound, preparation and application of corrosion inhibitor 中国科学院理化技术研究所 2021-03-30 CN claimed
CN-108003258-B Aryl imidazoline modified polyisobutene amine dispersant 浙江杭化科技股份有限公司 2020-09-18 CN claimed
CN-107945938-B A kind of polyimides cladding toughness electromagnetic wire 安徽天大铜业有限公司 2019-09-13 CN claimed
CN-110066694-A A kind of clean fuel and preparation method thereof 金玖洲新能源有限公司 2019-07-30 CN claimed
CN-110041794-A A kind of toughening type epoxy powder coating 李志平 2019-07-23 CN claimed
CN-109942493-A Oil base sulfonyl amido benzyl imidazoline cationic compound, its preparation, comprising its corrosion inhibiter, corrosion inhibiter preparation and application 中国科学院理化技术研究所 2019-06-28 CN claimed
CN-109678800-A Benzyl imidazoline cationic compound, corrosion inhibiter and preparation method and application 中国科学院理化技术研究所 2019-04-26 CN claimed
CN-108716142-A It is a kind of to pass through the pretreated yarn dyeing and finishing method of level dyeing 安徽找宝纺织科技有限公司 2018-10-30 CN claimed
CN-107945938-A A kind of polyimides coats toughness electromagnetic wire 安徽天大铜业有限公司 2018-04-20 CN claimed
CN-1927969-B Hybrid-powder paint composition having a low burning temperature for semi-glossy to matt coverings DEGUSSA 2011-03-02 CN claimed
CN-1909876-B Pearlizer concentrate and its use in personal care compositions RHODIA 2010-11-24 CN claimed
EP-1827423-B1 NOVEL CYCLIC UREAS USED AS INHIBITORS OF METALLOPROTEASES SANOFI AVENTIS DEUTSCHLAND (DE) 2010-06-30 EP claimed
WO-2009007110-A2 COMBINATION OF BENZYL-4,5-DIHYDRO-1H-IMIDAZOLE DERIVATIVE AND AN OPIOD RECPTOR LIGAND LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-01-15 WO claimed
EP-2014288-A1 Combination of benzyl-4, 5-dihydro-1H-imidazole derivative and an opioid receptor ligand Laboratorios del Dr. Esteve S.A. (ES) 2009-01-14 EP claimed
CN-1927969-A Hybrid-powder paint composition having a low burning temperature for semi-glossy to matt coverings DEGUSSA (DE) 2007-03-14 CN claimed
CN-1909876-A Pearlizer concentrate and its use in personal care compositions RHODIA (US) 2007-02-07 CN claimed
CN-1335848-A Process to prepare (5R)-(methylamino)-5,6-dihydro-4H-imidazo [4,5,1-ij]-Quinolin-2(1H)-one PHARMACIA & UP JOHN COMPANY (US) 2002-02-13 CN claimed
CN-1163916-A Effect powder coatings, their preparation and use HUELS CHEMISCHE WERKE AG (DE) 1997-11-05 CN claimed
EP-0385038-B1 ORTHO-SUBSTITUTED PHENYL AMIDINE AND PHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM The Boots Company PLC (GB) 1993-06-02 EP claimed