SCHEMBL174686

SCHEMBL174686

C=CCOC(=O)c1ccccc1OCC=C

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.74
LIG1 P18858 1/20 0.65
TSHR P16473 4/20 0.64
HSD17B10 Q99714 2/20 0.64
ALDH1A1 P00352 2/20 0.64
ADRB2 P07550 1/20 0.61
ADRB1 P08588 1/20 0.61
ADRB3 P13945 1/20 0.61
KDM4E B2RXH2 3/20 0.49
RHOA P61586 1/20 0.48
GAA P10253 2/20 0.48
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.46
CASP1 P29466 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL7314986 0.89 ADRB2 (0.60) CYP3A4LIG1TSHRHSD17B10ALDH1A1
SCHEMBL7136131 0.89 CYP3A4 (0.68) CYP3A4LIG1TSHRHSD17B10ALDH1A1
SCHEMBL10542058 0.88 LIG1 (0.67) CYP3A4LIG1TSHRHSD17B10ALDH1A1
SCHEMBL2407251 0.88 CYP3A4 (0.66) CYP3A4LIG1TSHRHSD17B10ALDH1A1
SCHEMBL10538212 0.87 CYP3A4 (0.74) CYP3A4LIG1TSHRHSD17B10ALDH1A1
SCHEMBL12904274 0.86 CYP3A4 (0.68) CYP3A4LIG1TSHRHSD17B10ALDH1A1
SCHEMBL16371573 0.86 CYP3A4 (1.00) CYP3A4LIG1TSHRHSD17B10ALDH1A1
SCHEMBL27474785 0.86 CYP3A4 (1.00) CYP3A4LIG1TSHRHSD17B10ALDH1A1
SCHEMBL29362146 0.86 CYP3A4 (1.00) CYP3A4LIG1TSHRHSD17B10ALDH1A1
SCHEMBL15174 0.86 CYP3A4 (1.00) CYP3A4LIG1TSHRHSD17B10ALDH1A1

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 1467 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115746937-B Diesel engine oil detergent composition and diesel engine oil composition 中国石油天然气股份有限公司 2024-05-28 CN claimed
CN-117925294-A Neutral alkylbenzene sulfonate additive and preparation method thereof 中国石油天然气股份有限公司 2024-04-26 CN claimed
CN-117343773-A Diesel engine oil composition 中国石油天然气股份有限公司 2024-01-05 CN claimed
CN-115851337-B Preparation method of alkaline calcium alkyl salicylate 新乡市瑞丰新材料股份有限公司 2023-12-22 CN claimed
CN-117069577-A Preparation method and system of alkyl salicylic acid 新乡市瑞丰新材料股份有限公司 2023-11-17 CN claimed
CN-114829558-B Lubricant composition containing detergent derived from cashew nutshell liquid 路博润公司 2023-11-17 CN claimed
CN-115247090-B Ultrahigh-base-number magnesium alkylbenzenesulfonate detergent and preparation method thereof 中国石油天然气股份有限公司 2023-10-27 CN claimed
CN-116676120-A High-temperature-resistant antioxidant lubricating oil detergent and preparation method thereof 湖南鸿福实业有限公司 2023-09-01 CN claimed
CN-116478749-A Preparation method of ultrahigh-base-number calcium sulfonate 中国石油天然气股份有限公司 2023-07-25 CN claimed
CN-116478747-A Preparation method of high-base-number magnesium salicylate detergent 中国石油天然气股份有限公司 2023-07-25 CN claimed
US-4845003-A COMPLEX COMPOUND OF ALUMINUM AND AN AROMATIC HYDROXYCARBOXYLIC ACID ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1989-07-04 US claimed
US-4810398-A OIL AND FUEL ADDITIVES SHELL OIL COMPANY (US) 1989-03-07 US claimed
EP-0298572-A1 Process for the preparation of a basic salt, salt thus prepared and oil compositions containing such a salt SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-01-11 EP claimed
EP-0279493-A2 Process for the preparation of a basic salt, salt thus prepared and oil compositions containing such a salt SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1988-08-24 EP claimed
US-4749638-A CARBON BLACK, DISPERSANT, POLYMERIC BINDER OIL PHASE EMULSION POLYMERIZATION KAO CORPORATION (JP) 1988-06-07 US claimed
EP-0201340-A2 Toner composition and method for preparing the same Kao Corporation (JP) 1986-11-12 EP claimed
US-4354949-A OIL IN WATER EMULSION SHELL OIL COMPANY (US) 1982-10-19 US claimed
EP-0033170-A2 Hydraulic fluid, hydraulic equipment containing this fluid and a concentrate of this fluid SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1981-08-05 EP claimed
US-4206064-A Negatively charged toner for developing electrostatic images containing metal complex of salicyclic acid compound as charge control agent CANON KABUSHIKI KAISHA (JP) 1980-06-03 US claimed
US-3995097-A Prevention of fouling in polymerization reactors PHILLIPS PETROLEUM COMPANY (US) 1976-11-30 US claimed