SCHEMBL5373779

SCHEMBL5373779

Cc1c(Cl)cccc1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.62
PDCD1 Q15116 2/20 0.53
CD274 Q9NZQ7 2/20 0.53
HSD11B1 P28845 2/20 0.47
ALDH1A1 P00352 4/20 0.46
IDO1 P14902 1/20 0.46
PTGS2 P35354 2/20 0.43
PTGS1 P23219 1/20 0.43
CNR2 P34972 1/20 0.42
HCRTR1 O43613 2/20 0.41
HCRTR2 O43614 2/20 0.41
MAPK14 Q16539 1/20 0.40
CTSA P10619 1/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
MT-CO2 P00403 1/20 0.40
TTR P02766 1/20 0.40
PLA2G1B P04054 1/20 0.40

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
SCHEMBL29468031 1.00 CYP2A6 (0.62) CYP2A6PDCD1CD274HSD11B1ALDH1A1
O-Xylene SCHEMBL28322428 0.94 CYP2A6 (0.56) CYP2A6PDCD1CD274HSD11B1ALDH1A1
SCHEMBL28322430 0.84 CYP2A6 (0.54) CYP2A6PDCD1CD274HSD11B1ALDH1A1
SCHEMBL10961604 0.83 ALDH1A1 (0.52) CYP2A6HSD11B1ALDH1A1IDO1PTGS2
SCHEMBL25785668 0.83 PDCD1 (0.64) CYP2A6PDCD1CD274ALDH1A1PTGS2
SCHEMBL11057698 0.82 CYP2A6 (0.50) CYP2A6PDCD1CD274HSD11B1ALDH1A1
SCHEMBL28400046 0.81 TP53 (0.46) CYP2A6HSD11B1ALDH1A1IDO1PTGS2
Ammonia Solution, Strong SCHEMBL27977448 0.80 CYP2A6 (0.48) CYP2A6PDCD1CD274HSD11B1ALDH1A1
SCHEMBL31156157 0.79 SRD5A2 (0.47) ALDH1A1PTGS2HPGDLMNAMEN1
SCHEMBL23628571 0.78 CYP2A6 (1.00) CYP2A6HSD11B1ALDH1A1PTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116606191-A Preparation method of 3-chloro-2-methyl biphenyl 辽宁氟托新能源材料有限公司 2023-08-18 CN claimed
CN-111187144-A Synthetic method of 3-chloro-2-methyl biphenyl and derivatives thereof 江苏优嘉植物保护有限公司 2020-05-22 CN claimed
CN-110204415-A A kind of synthetic method of 3- chloro-2-methyl biphenyl 王海峻 2019-09-06 CN claimed
CN-106833260-A A kind of insulated metal product surface processing method 安徽宝恒新材料科技有限公司 2017-06-13 CN claimed
CN-103626629-B Rectification method of 3-chlorine-2-methyl diphenyl YANCHENG CONFIDENT BIOCHEMICAL TECHNOLOGY CO LTD 2015-05-20 CN claimed
CN-102964217-B Method for preparing 2-methyl-3-biphenylmethyanol through continuous Grignard and hydroxylation reactions JIANGSU YOUJIA CHEMISTRY CO., LTD. (CN) 2014-10-01 CN claimed
CN-103626629-A Rectification method of 3-chlorine-2-methyl diphenyl YANCHENG CONFIDENT BIOCHEMICAL TECHNOLOGY CO LTD 2014-03-12 CN claimed
CN-101704723-B Preparation method of hydroxymethyl substitutent o-alkyl biphenyl and intermediate thereof SHANGHAI WANSU CHEMICAL CO LTD 2013-04-24 CN claimed
CN-102964217-A Method for preparing 2-methyl-3-biphenylmethyanol through continuous Grignard and hydroxylation reactions JIANGSU YANGNONG CHEMICAL CO 2013-03-13 CN claimed
EP-1667958-A2 MELANIN CONCENTRATING HORMONE ANTAGONISTS THE PROCTER & GAMBLE COMPANY (US) 2006-06-14 EP claimed
WO-2005033063-A2 MELANIN CONCENTRATING HORMONE ANTAGONISTS THE PROCTER & GAMBLE COMPANY (US) 2005-04-14 WO claimed
US-20050075324-A1 Melanin concentrating hormone antagonists THE PROCTER & GAMBLE COMPANY (US) 2005-04-07 US claimed
EP-0152450-B1 CATALYZED GRIGNARD COUPLING PROCESS FMC Corporation (US) 1989-05-03 EP claimed
EP-0152450-A4 CATALYZED GRIGNARD COUPLING PROCESS. FMC CORP (US) 1985-12-05 EP claimed
EP-0152450-A1 CATALYZED GRIGNARD COUPLING PROCESS. FMC CORP (US) 1985-08-28 EP claimed
US-4507513-A NICKEL ACETYLACETONE AS CATALYST FMC CORPORATION (US) 1985-03-26 US claimed
WO-1985001045-A1 CATALYZED GRIGNARD COUPLING PROCESS FMC CORPORATION (US) 1985-03-14 WO claimed
US-4465879-A 3-HALO-2-METHYL(1,1*-BIPHENYL) FROM HALOBENZENE WITH 3-HALO-2-METHYLPHENYLMAGNESIUM HALIDE AND PALLADIUM CATALYST FMC CORPORATION (US) 1984-08-14 US claimed
CN-113429256-B Preparation method of bifenthrin insecticide intermediate 湖南华腾制药有限公司 2024-07-26 CN disclosed
EP-0021228-A1 4-Substituted-3-hydroxy-3-pyrroline-2,5-dione compounds, process for their preparation and pharmaceutical compositions containing the same MERCK & CO. INC. (US) 1981-01-07 EP 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 (1 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-20050075324-A1 Melanin concentrating hormone antagonists MCHR1, MCHR2, MC1R CYP2A6 614/4885PDCD1 4374/4885CD274 3453/4885

“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.