SCHEMBL176299

SCHEMBL176299

C=CCC(=O)CCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.50
FAAH O00519 3/20 0.50
KMT2A Q03164 2/20 0.50
MAPT P10636 1/20 0.50
CES2 O00748 4/20 0.48
CES1 P23141 4/20 0.48
AKR1B1 P15121 1/20 0.46
HAO1 Q9UJM8 1/20 0.45
PPARG P37231 6/20 0.44
PPARD Q03181 6/20 0.44
PPARA Q07869 6/20 0.44
GPR84 Q9NQS5 5/20 0.44
HDAC11 Q96DB2 5/20 0.44
ALDH1A1 P00352 2/20 0.44
TLR2 O60603 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
FABP4 P15090 2/20 0.44
PTPN1 P18031 2/20 0.44
SLC22A6 Q4U2R8 1/20 0.44
SLC22A8 Q8TCC7 1/20 0.44

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
SCHEMBL9539734 0.98 TSHR (0.48) TSHRFAAHKMT2AMAPTCES2
SCHEMBL3131865 0.98 KMT2A (0.54) TSHRFAAHKMT2AMAPTCES2
SCHEMBL11795366 0.98 KMT2A (0.54) TSHRFAAHKMT2AMAPTCES2
Hydrogen Sulfide SCHEMBL9539728 0.98 TSHR (0.48) TSHRFAAHKMT2AMAPTCES2
SCHEMBL9295757 0.98 KMT2A (0.54) TSHRFAAHKMT2AMAPTCES2
SCHEMBL11796286 0.98 KMT2A (0.54) TSHRFAAHKMT2AMAPTCES2
SCHEMBL3632919 0.98 KMT2A (0.54) TSHRFAAHKMT2AMAPTCES2
Hydrochloric Acid SCHEMBL3088650 0.98 TSHR (0.48) TSHRFAAHKMT2AMAPTCES2
Hydrochloric Acid SCHEMBL3634285 0.96 KMT2A (0.52) TSHRFAAHKMT2AMAPTCES2
SCHEMBL29284351 0.96 KMT2A (0.52) TSHRFAAHKMT2AMAPTCES2

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

Appears in 2630 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118271246-A Method for continuously preparing 2-butyl-1, 3-diazaspiro [4.4] nonane-1-en-4-one 浙江华海药业股份有限公司 2024-07-02 CN claimed
CN-118084828-A Method for preparing epoxy compound by catalytic oxidation of olefin 中国科学院大连化学物理研究所 2024-05-28 CN claimed
CN-118019729-A Process for the preparation of sartan 新梅斯托克公司 2024-05-10 CN claimed
CN-117986239-A Irbesartan preparation method 珠海润都制药股份有限公司 2024-05-07 CN claimed
CN-117891131-A Hydrophobic low-temperature cured resin composition and preparation method and application thereof 阜阳欣奕华材料科技有限公司 2024-04-16 CN claimed
CN-115181210-B Acidic hydrogel film with high proton conductivity and fuel cell application thereof 四川大学 2023-11-21 CN claimed
CN-116836627-A UV curing release agent, preparation method thereof, release film and self-adhesive modified asphalt waterproof coiled material 南通金丝楠膜材料有限公司 2023-10-03 CN claimed
US-20230235204-A1 CURABLE PRECURSOR OF A STRUCTURAL ADHESIVE COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY 2023-07-27 US claimed
CN-116039075-B Rapid liquid phase 3D printing method for preparing PEDOT (polyethylene glycol terephthalate)/PSS (polybutylene terephthalate) flexible wire 四川大学 2023-06-20 CN claimed
WO-2023103424-A1 ANIONIC EXPLOSION-PROOF MEMBRANE AND PREPARATION METHOD THEREFOR 湖北航天化学技术研究所 2023-06-15 WO claimed
EP-0015221-B1 PROCESS FOR THE PREPARATION OF PARA-BENZOQUINONES RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1981-12-02 EP claimed
US-4237306-A ELECTROPHILIC REACTIONS WITH ALKYL ARYL KETONES TO PRODUCE METHYL ARYL ALKANOATES EMERY INDUSTRIES, INC. (US) 1980-12-02 US claimed
US-4225511-A Direct oximation of ketones using gallia catalysts ALLIED CHEMICAL CORPORATION (US) 1980-09-30 US claimed
EP-0014207-A1 EPOXY SURFACER CEMENTS CURED WITH POLYAMINE-KETIMINE MIXTURES AMERON, INC. (US) 1980-08-20 EP claimed
EP-0014207-A4 EPOXY SURFACER CEMENTS CURED WITH POLYAMINE-KETIMINE MIXTURES. AMERON INC (US) 1980-03-18 EP claimed
WO-1979000903-A1 EPOXY SURFACER CEMENTS CURED WITH POLYAMINE-KETIMINE MIXTURES AMERON INC (US) 1979-11-15 WO claimed
EP-0004676-A1 Direct oximation of ketones ALLIED CORPORATION (US) 1979-10-17 EP claimed
US-4163756-A WITH AMMONIA AND OXYGEN AND CATALYST OF SILICA, ALUMINA, BORON NITRIDE, MAGNESIA, ZIRCONIA, ZINC OXIDE AND/OR TRANSITION METAL OXIDE ALLIED CHEMICAL CORPORATION (US) 1979-08-07 US claimed
US-4148950-A CURING AGENTS AMERON, INC. (US) 1979-04-10 US claimed
US-4017313-A Photosensitive composition containing a leuco dye, a photosensitizer, an aromatic aldehyde and a secondary or tertiary amine and the use thereof in a direct-print process E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-04-12 US claimed