SCHEMBL2374259

SCHEMBL2374259

CCCN(CCC)CCC.OB(O)Oc1cccc2ccc3cc4ccccc4cc3c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 3/20 0.38
HTR1D P28221 2/20 0.36
DRD2 P14416 2/20 0.34
DRD3 P35462 2/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
BCHE P06276 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
DRD1 P21728 1/20 0.33
DRD4 P21917 1/20 0.33
DRD5 P21918 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
KMT2A Q03164 1/20 0.32
RXRA P19793 1/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32

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
SCHEMBL911197 0.93 HTR1B (0.47) HTR1BHTR1DDRD2DRD3OPRM1
SCHEMBL911247 0.90 HTR1B (0.35) HTR1BHTR1DALDH1A1TSHRHSD17B10
Trolamine SCHEMBL3453642 0.89 KDM4E (0.33) HTR1BALDH1A1TSHRHSD17B10KMT2A
Trimethylammonium SCHEMBL911336 0.87 CYP1A2 (0.37) HTR1BALDH1A1HSD17B10SIGMAR1KMT2A
SCHEMBL19259375 0.87 CYP1A2 (0.41) ALDH1A1TSHRHSD17B10SIGMAR1KMT2A
Hydrogen Sulfide SCHEMBL17372873 0.85 CYP1A2 (0.40) ALDH1A1TSHRHSD17B10SIGMAR1KMT2A
SCHEMBL1314570 0.85 CYP1A2 (0.40) ALDH1A1TSHRHSD17B10SIGMAR1KMT2A
SCHEMBL911163 0.85 CYP1A2 (0.40) ALDH1A1TSHRHSD17B10KMT2ARXRA
Ammonia Solution, Strong SCHEMBL1035827 0.85 CYP1A2 (0.40) ALDH1A1TSHRHSD17B10SIGMAR1KMT2A
Phosphine SCHEMBL3288817 0.85 CYP1A2 (0.40) ALDH1A1TSHRHSD17B10SIGMAR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119708303-A Novel branched polyethylene and preparation method thereof 中国石油化工股份有限公司 2025-03-28 CN claimed
CN-119708305-A Branching polyethylene with adjustable and controllable branching degree and preparation method thereof 中国石油化工股份有限公司 2025-03-28 CN claimed
CN-119708304-A Branched polyethylene with fast vulcanization speed and preparation method thereof 中国石油化工股份有限公司 2025-03-28 CN claimed
CN-115362187-A Polyethylene compositions obtained using transition metal bis (phenolate) catalyst complexes and homogeneous processes for producing the same 埃克森美孚化学专利公司 2022-11-18 CN claimed
CN-115315455-A Ethylene-alpha-olefin-diene monomer copolymers obtained using transition metal bis (phenolate) catalyst complexes and homogeneous processes for producing the same 埃克森美孚化学专利公司 2022-11-08 CN claimed
CN-114929761-A With C 1 Isotactic propylene homopolymers and copolymers produced by symmetric metallocene catalysts 埃克森美孚化学专利公司 2022-08-19 CN claimed
CN-113614123-A Transition metal bis (phenolate) complexes and their use as olefin polymerization catalysts 埃克森美孚化学专利公司 2021-11-05 CN claimed
CN-113423742-A Bis (arylphenolate) lewis base catalysts and processes thereof 埃克森美孚化学专利公司 2021-09-21 CN claimed
CN-113423744-A Lewis base catalyst and process therefor 埃克森美孚化学专利公司 2021-09-21 CN claimed
CN-119912601-A Composite catalyst and method for preparing branched polyethylene 中国石油化工股份有限公司 2025-05-02 CN disclosed
CN-119836425-A Ligand compound, organic chromium compound, and catalyst composition comprising same 株式会社LG化学 2025-04-15 CN disclosed
CN-119798504-A Propylene/alpha-olefin copolymer, preparation method and application thereof 万华化学集团股份有限公司 2025-04-11 CN disclosed
CN-119708304-A Branched polyethylene with fast vulcanization speed and preparation method thereof 中国石油化工股份有限公司 2025-03-28 CN disclosed
CN-119708354-A Scandium catalyst system and method for producing ethylene/butadiene copolymer 固特异轮胎和橡胶公司 2025-03-28 CN disclosed
US-6423659-B1 π-complex compounds BAYER AKTIENGESELLSCHAFT (DE) 2002-07-23 US disclosed
CN-1226255-A Saturated tricyclic ligand containing metal complexes and olefin polymerization process DOW CHEMICAL CO (US) 1999-08-18 CN disclosed
CN-1216548-A Yttrium-containing metal complexes and olefin polymerization process DOW CHEMICAL CO (US) 1999-05-12 CN disclosed
EP-0767804-A1 POLYMERIZATION PROCESS USING DIENE CONTAINING CATALYSTS THE DOW CHEMICAL COMPANY (US) 1997-04-16 EP disclosed
EP-0705269-B1 TITANIUM(II) OR ZIRCONIUM(II) COMPLEXES AND ADDITION POLYMERIZATION CATALYSTS THEREFROM DOW CHEMICAL CO (US) 1997-01-15 EP disclosed
WO-1996000742-A1 POLYMERIZATION PROCESS USING DIENE CONTAINING CATALYSTS THE DOW CHEMICAL COMPANY (US) 1996-01-11 WO disclosed