SCHEMBL5853830

SCHEMBL5853830

CCC1(c2ccccc2)CCCCC1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.63
SLC6A2 P23975 3/20 0.63
SLC6A3 Q01959 3/20 0.63
DPP4 P27487 1/20 0.61
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
CHRM2 P08172 1/20 0.47
CHRM1 P11229 1/20 0.47

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
SCHEMBL21351801 0.98 SLC6A4 (0.61) SLC6A4SLC6A2SLC6A3DPP4MAOA
SCHEMBL9330358 0.98 DPP4 (0.63) SLC6A4SLC6A2SLC6A3DPP4MAOA
SCHEMBL10606137 0.93 DPP4 (0.57) SLC6A4SLC6A2SLC6A3DPP4MAOA
SCHEMBL15955086 0.89 MAOA (0.60) SLC6A4SLC6A2SLC6A3DPP4MAOA
SCHEMBL2089640 0.83 SLC6A4 (0.59) SLC6A4SLC6A2SLC6A3DPP4MAOA
SCHEMBL15568275 0.80 SLC6A4 (0.56) SLC6A4SLC6A2SLC6A3DPP4CHRM2
SCHEMBL19123555 0.80 SLC6A4 (0.50) SLC6A4SLC6A2SLC6A3DPP4CHRM2
SCHEMBL14513169 0.79 ALDH1A1 (0.50) SLC6A4SLC6A2SLC6A3DPP4MAOA
SCHEMBL3246807 0.79 TACR1 (0.56) SLC6A4MAOAMAOBTAAR1
SCHEMBL21899382 0.79 SLC6A3 (0.42) SLC6A4SLC6A2SLC6A3DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110437047-A A kind of ethylcyclohexyl phenylalkyl ketone compound and preparation method thereof for display material YANTAI FENGLU FINE CHEMICAL CO LTD 2019-11-12 CN claimed
CN-101560396-B Method for synthesizing fluorine-containing antiform alkyl cyclohexyl biphenyl single liquid crystal LAIYANG SHENGHUA TECHNOLOGY CO LTD 2012-07-25 CN claimed
CN-101560396-A Method for synthesizing fluorine-containing antiform alkyl cyclohexyl biphenyl single liquid crystal LAIYANG SHENGHUA TECHNOLOGY CO (CN) 2009-10-21 CN claimed
US-7091290-B2 Method for preparing homo-and co-polymers of cyclic olefin compounds using an organic boron compound as a catalyst activator KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2006-08-15 US claimed
CN-1201182-C Liquid crystal display contg. chiral dopant MERCK PATENT GMBH (DE) 2005-05-11 CN claimed
CN-1420382-A Liquid crystal display contg. chiral dopant MERCK PATENT GMBH (DE) 2003-05-28 CN claimed
EP-0444448-A2 Phenylcyclohexylethane and liquid crystal medium MERCK PATENT GmbH (DE) 1991-09-04 EP claimed
US-10858298-B2 Preparation of diphenyl compounds EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2020-12-08 US disclosed
US-10787399-B2 Preparation and use of phenylstyrene EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-09-29 US disclosed
CN-110437047-A A kind of ethylcyclohexyl phenylalkyl ketone compound and preparation method thereof for display material YANTAI FENGLU FINE CHEMICAL CO LTD 2019-11-12 CN disclosed
US-20190315665-A1 PREPARATION OF DIPHENYL COMPOUNDS EXXONMOBIL RES & ENG CO (US) 2019-10-17 US disclosed
CN-110325522-A Liquid crystal compounds 默克专利股份有限公司 2019-10-11 CN disclosed
CN-110023283-A Sulfide compound 默克专利股份有限公司 2019-07-16 CN disclosed
CN-1040024-A 2, the 3-Difluorophenol derivatives MERCK PATENT GMBH (DE) 1990-02-28 CN disclosed
CN-1037334-A Pyridine derivate MERCK PATENT GMBH (DE) 1989-11-22 CN disclosed
CN-1032435-A The phenyl trifluoromethyl ethers that replaces MERCK PATENT GMBH (DE) 1989-04-19 CN disclosed
US-4802058-A DISTILLATION, DEHYDROGENATION, DISTILLATION, AND HYDROGENATION NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-01-31 US disclosed
EP-0282013-A2 Novel method for refining electrical insulating oil NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-09-14 EP disclosed
EP-0272580-A2 Liquidcrystalline cyclohexylbenzene derivatives their manufacturing and novel nematic admixtures containing same Wojskowa Akademia Techniczna im. Jaroslawa Dabrowskiego (PL) 1988-06-29 EP disclosed
US-4371726-A Composition suitable for mechanical power transmission and process for operating traction drives NIPPON STEEL CHEMICAL CO., LTD. (JP) 1983-02-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190315665-A1 PREPARATION OF DIPHENYL COMPOUNDS DDT, PCBP1, BMI1 SLC6A4 4510/4885SLC6A2 4682/4885SLC6A3 3874/4885
US-10858298-B2 Preparation of diphenyl compounds DDT, PCBP1, BMI1 SLC6A4 4510/4885SLC6A2 4682/4885SLC6A3 3874/4885
US-10787399-B2 Preparation and use of phenylstyrene HPD, P4HB, PAH SLC6A4 2221/4885SLC6A2 3348/4885SLC6A3 2516/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.