SCHEMBL598650

SCHEMBL598650

CCCc1ccc(C)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.50
CNR2 P34972 1/20 0.50
SKP2 Q13309 1/20 0.50
FFAR4 Q5NUL3 1/20 0.44
LPL P06858 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
ALOX5 P09917 1/20 0.39
CA2 P00918 1/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C9 P11712 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
CYP4Z1 Q86W10 1/20 0.39
CYP4F11 Q9HBI6 1/20 0.39
CYP4F12 Q9HCS2 1/20 0.39
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
CTSK P43235 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 SCHEMBL2446312 0.95 SKP2 (0.47) CNR1CNR2SKP2FFAR4LPL
SCHEMBL29380988 0.87 PTGS1 (0.45) CNR1SKP2CYP3A4CYP2D6CYP2C9
SCHEMBL311370 0.87 PTGS1 (0.45) CNR1SKP2CYP3A4CYP2D6CYP2C9
SCHEMBL29597103 0.87 PTGS1 (0.45) CNR1SKP2CYP3A4CYP2D6CYP2C9
SCHEMBL5838115 0.86 SKP2 (0.68) SKP2CA2CYP3A4CYP2D6CYP2C9
SCHEMBL17866573 0.84 SKP2 (0.60) SKP2LPLLIPGCYP3A4CYP2D6
SCHEMBL10608353 0.82 SKP2 (0.58) SKP2LPLLIPGCYP3A4ALDH1A1
SCHEMBL9298886 0.82 SKP2 (0.58) SKP2LPLLIPGCYP3A4ALDH1A1
SCHEMBL1263571 0.81 CNR1 (0.47) CNR1CNR2SKP2FFAR4LPL
SCHEMBL19624476 0.80 HRH3 (0.43) CNR1CNR2SKP2FFAR4ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0192492-B1 PEPTIDES CONTAINING AN ALIPHATIC-AROMATIC KETONE SIDE CHAIN THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1992-01-02 EP claimed
CN-116607159-B Hydroxyethyl disulfide and preparation method and application thereof 广东药科大学 2025-06-13 CN disclosed
CN-117658959-A Polysubstituted polysulfide furan derivative and preparation method and application thereof 广东药科大学 2024-03-08 CN disclosed
CN-116607159-A Hydroxyethyl disulfide and preparation method and application thereof 广东药科大学 2023-08-18 CN disclosed
CN-116157402-A Material for organic electroluminescent device 默克专利有限公司 2023-05-23 CN disclosed
EP-3119768-B1 3,4-BROMO OR -SULFONATE SUBSTITUTED 1H-PYRROLE-2,5-DIONE DERIVATIVES AS TYPE III DEIODINASE (DIO3) INHIBITORS FOR TREATING DEPRESSIONS AND CANCER HADASIT MED RES SERVICE (IL) 2019-07-31 EP disclosed
WO-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed
WO-2017106820-A1 ANTIVIRAL AGENTS FOR DRUG-RESISTANT INFLUENZA A THOMAS JEFFERSON UNIVERSITY (US) 2017-06-22 WO disclosed
US-9145522-B2 Enhanced aromatics production by low pressure end point reduction and selective hydrogenation and hydrodealkylation UOP LLC (US) 2015-09-29 US disclosed
US-20130165719-A1 ENHANCED AROMATICS PRODUCTION BY LOW PRESSURE END POINT REDUCTION AND SELECTIVE HYDROGENATION AND HYDRODEALKYLATION UOP LLC (US) 2013-06-27 US disclosed
EP-1167366-A1 AMINE DERIVATIVES Sankyo Company, Limited (JP) 2002-01-02 EP disclosed
EP-1167357-A1 ALPHA-SUBSTITUTED CARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 2002-01-02 EP disclosed
EP-1070711-A2 Heteroaryl-substituted pyrrole derivatives, their preparation and their therapeutic uses Sankyo Company Limited (JP) 2001-01-24 EP disclosed
US-5792840-A SUBSTITUTED GLUCOPYRANOSYL PHOSPHATES SANKYO COMPANY, LIMITED (JP) 1998-08-11 US disclosed
EP-0437016-B1 Lipid A analogues having immunoactivating and anti-tumour activity SANKYO CO (JP) 1996-05-01 EP disclosed
EP-0192492-B1 PEPTIDES CONTAINING AN ALIPHATIC-AROMATIC KETONE SIDE CHAIN THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1992-01-02 EP disclosed
EP-0437016-A2 Lipid A analogues having immunoactivating and anti-tumour activity Sankyo Company Limited (JP) 1991-07-17 EP disclosed
US-4677193-A GONADOTROPIN-RELEASING FACTOR ANALOGS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1987-06-30 US disclosed
EP-0192492-A2 Peptides containing an aliphatic-aromatic ketone side chain THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1986-08-27 EP disclosed
US-4213967-A Pesticide containing ignition inhibitor DR. WERNER FREYBERG, CHEMISCHE FABRIK DELITIA NACHF. (DE) 1980-07-22 US disclosed