SCHEMBL536902

SCHEMBL536902

[CH2]C(CCCC)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
SIGMAR1 Q99720 1/20 0.41
LMNA P02545 1/20 0.40
HTR2A P28223 6/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
OPRL1 P41146 1/20 0.40
MAPT P10636 1/20 0.40
HRH1 P35367 5/20 0.39
AOC3 Q16853 1/20 0.39
CNR2 P34972 1/20 0.39
NAAA Q02083 2/20 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
SCHEMBL1024126 0.94 SIGMAR1 (0.44) POLBALDH1A1KDM4ESIGMAR1LMNA
SCHEMBL7568454 0.92 HTR2A (0.45) POLBALDH1A1SIGMAR1HTR2AOPRM1
SCHEMBL27654305 0.92 HTR2A (0.45) POLBALDH1A1SIGMAR1HTR2AOPRM1
SCHEMBL6060853 0.92 HTR2A (0.45) POLBALDH1A1SIGMAR1HTR2AOPRM1
SCHEMBL4562598 0.92 HTR2A (0.45) POLBALDH1A1SIGMAR1HTR2AOPRM1
SCHEMBL28188141 0.92 HTR2A (0.45) POLBALDH1A1SIGMAR1HTR2AOPRM1
SCHEMBL19260197 0.92 HTR2A (0.45) POLBALDH1A1SIGMAR1HTR2AOPRM1
SCHEMBL6395339 0.91 POLB (0.40) POLBALDH1A1KDM4ESIGMAR1LMNA
SCHEMBL5167355 0.88 CYP17A1 (0.49) POLBKDM4E
SCHEMBL135231 0.86 AOC3 (0.46) SIGMAR1LMNAHTR2AHRH1AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112479875-A Method for preparing alpha-oxo-carboxylic ester by selective oxidation of alpha-hydroxy-carboxylic ester 厦门大学 2021-03-12 CN claimed
CN-1738829-B New 2',5'-oligoadenylic acid analog SANKYO CO 2012-11-28 CN claimed
CN-100554233-C The preparation method of alpha-oxocarbonyl compound KURARAY CO (JP) 2009-10-28 CN claimed
EP-0944656-B1 PROCESS FOR PREPARING RUBBER-MODIFIED MOULDING COMPOUNDS BASF AG (DE) 2001-07-11 EP claimed
US-6211297-B1 ANIONIC POLYMERIZATION; MOLDING MATERIALS BASF AKTIENGESELLSCHAFT (DE) 2001-04-03 US claimed
US-4085141-A Process for the preparation of anilines meta-substituted by chlorine BAYER AKTIENGESELLSCHAFT (DT) 1978-04-18 US claimed
CN-113710637-B Preparation method of biaryl phosphine 日本化学工业株式会社 2023-10-24 CN disclosed
WO-2023182221-A1 METHOD FOR PRODUCING QUANTUM DOTS 日本化学工業株式会社 2023-09-28 WO disclosed
CN-111655708-B 2, 3-biphosphinopyrazine derivative, process for producing the same, complex compound, catalyst, and process for producing organoboron compound 日本化学工业株式会社 2023-08-25 CN disclosed
US-11718758-B2 Aqueous dispersion of colored particles MITSUBISHI PENCIL COMPANY, LIMITED (JP) 2023-08-08 US disclosed
EP-3725854-B1 COLORED PARTICLE AQUEOUS DISPERSION MITSUBISHI PENCIL CO (JP) 2023-07-05 EP disclosed
CN-111465662-B Aqueous dispersion of coloured particles 三菱铅笔株式会社 2023-05-26 CN disclosed
CN-111032668-B Optically active 2,3-bisphosphinylpyrazine derivative, process for producing the same, transition metal complex, and process for producing organoboron compound 日本化学工业株式会社 2022-10-14 CN disclosed
US-4163865-A Process for the preparation of pinacols BAYER AKTIENGESELLSCHAFT (DE) 1979-08-07 US disclosed
EP-0001275-A1 Method of production of sulfonylchlorides BAYER AG (DE) 1979-04-04 EP disclosed
US-4085141-A Process for the preparation of anilines meta-substituted by chlorine BAYER AKTIENGESELLSCHAFT (DT) 1978-04-18 US disclosed
US-4066616-A ORGANIC POLYMERS CIBA-GEIGY CORPORATION (US) 1978-01-03 US disclosed
US-4035395-A Process for the preparation of ketones BAYER AKTIENGESELLSCHAFT (DT) 1977-07-12 US disclosed
US-3975367-A PEPTIDE, VIRICIDE, IMMUNOSUPPRESSANT, NEOPLASTIC CELLS THE UPJOHN COMPANY (US) 1976-08-17 US disclosed
US-3956298-A POLYMER STABILIZERS CIBA-GEIGY CORPORATION (US) 1976-05-11 US disclosed