SCHEMBL5350084

SCHEMBL5350084

CC1(C)CCC(Cc2ccc(Cl)cc2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.40
TSHR P16473 1/20 0.40
TRPA1 O75762 1/20 0.39
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
CCR5 P51681 1/20 0.36
CMA1 P23946 1/20 0.36
CNR1 P21554 2/20 0.35
FFAR1 O14842 1/20 0.35
CNR2 P34972 1/20 0.35
LMNA P02545 1/20 0.35
PPARG P37231 1/20 0.35

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
SCHEMBL15822934 0.92 FFAR1 (0.44) MAOBTSHRTRPA1ALDH1A1FFAR1
SCHEMBL9147038 0.91 TRPA1 (0.40) MAOBTSHRTRPA1ALDH1A1SMN1; SMN2
Tetrahydrofuran SCHEMBL28855326 0.90 HSD11B1 (0.40) MAOBTSHRTRPA1ALDH1A1CCR5
SCHEMBL9148468 0.89 HSD11B1 (0.40) MAOBTSHRTRPA1ALDH1A1
SCHEMBL17135362 0.89 TSHR (0.39) MAOBTSHRTRPA1ALDH1A1CCR5
SCHEMBL9144305 0.85 L3MBTL1 (0.40) TRPA1ALDH1A1SMN1; SMN2CCR5
SCHEMBL31440790 0.84 HTR6 (0.42) TSHRALDH1A1
SCHEMBL12162441 0.83 DDB1 (0.49) MAOBALDH1A1LMNA
SCHEMBL1785146 0.83 MAOB (0.42) MAOBTSHRALDH1A1SMN1; SMN2CMA1
SCHEMBL15641193 0.83 MAOB (0.38) MAOBTSHRTRPA1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118930414-B Synthetic process method of 5- [ (4-chlorophenyl) methyl ] -2, 2-dimethyl cyclopentanone 淮北龙溪生物科技有限公司 2025-02-07 CN claimed
CN-119390657-A Novel process for synthesizing high-purity metconazole 江苏剑牌农化科技有限公司 2025-02-07 CN claimed
CN-119118933-A Green preparation method of metconazole 江苏剑牌农化科技有限公司 2024-12-13 CN claimed
CN-118930414-A Synthetic process method of 5- [ (4-chlorophenyl) methyl ] -2, 2-dimethyl cyclopentanone 淮北龙溪生物科技有限公司 2024-11-12 CN claimed
CN-118146096-A 2, 2-Dimethyl-5- (4-chlorobenzyl) cyclopentanone derivative and preparation method thereof 浙江大学 2024-06-07 CN claimed
CN-118084640-A Preparation method of metconazole key intermediate 5- (4-chlorophenyl) methyl-2, 2-dimethylcyclopentanone 临海市建新化工有限公司 2024-05-28 CN claimed
CN-114773279-B Novel synthesis method of metconazole 浙江工业大学 2023-12-05 CN claimed
CN-114773279-A Novel synthesis method of metconazole 浙江工业大学 2022-07-22 CN claimed
CN-113429273-A Synthesis method of metconazole intermediate 江苏省农用激素工程技术研究中心有限公司 2021-09-24 CN claimed
CN-106045830-B Preparation method of 2, 2-dimethyl-5- (4-chlorobenzyl) cyclopentanone 上海试四赫维化工有限公司 2021-07-09 CN claimed
CN-104591989-A Method for preparing 5-[(4-chlorophenyl)methyl]-2,2-dimethyl-cyclopentanone SHANGHAI HUAYI GROUP CO 2015-05-06 CN claimed
US-7166750-B1 Process for the preparation of 5-[(4-chlorophenyl)methyl]-2,2-dimethylcyclopentanone KUREHA CORPORATION (JP) 2007-01-23 US claimed
EP-1308432-B1 PROCESS FOR THE PREPARATION OF 5- (4-CHLOROPHENYL)-METHYL|-2,2-DIMETHYLCYCLOPENTANONE KUREHA CORP (JP) 2006-10-18 EP claimed
EP-1289938-B1 A PROCESS FOR THE PREPARATION OF 2,2-DIMETHYL-5-(4-CLOROBENZYL) CYCLOPENTANONE AND AN INTERMEDIATE USEFUL THEREFOR BASF AG (DE) 2004-05-12 EP claimed
CN-1454200-A Process for the preparation of 5-[4-chlorophenyl)-methyl]-2, 2-dimethylcyclopentanone KUREHA CHEMICAL IND CO LTD (JP) 2003-11-05 CN claimed
EP-1308432-A1 PROCESS FOR THE PREPARATION OF 5- (4-CHLOROPHENYL)-METHYL]-2,2-DIMETHYLCYCLOPENTANONE KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2003-05-07 EP claimed
EP-1289938-A2 A PROCESS FOR THE PREPARATION OF 2,2-DIMETHYL-5-(4-CLOROBENZYL) CYCLOPENTANONE AND AN INTERMEDIATE USEFUL THEREFOR BASF AKTIENGESELLSCHAFT (DE) 2003-03-12 EP claimed
US-6344580-B1 CHEMICAL INTERMEDIATE FOR FUNGICIDE BASF AKTIENGESELLSCHAFT (DE) 2002-02-05 US claimed
US-20020013489-A1 Process for the preparation of 2,2-dimethyl-5-(4-chlorobenzyl) cyclopentanone and an intermediate useful therefore BASF AKTIENEGESELLSCHAFT (DE) 2002-01-31 US claimed
WO-2002000608-A2 A PROCESS FOR THE PREPARATION OF 2,2-DIMETHYL-5-(4-CHLOROBENZYL) CYCLOPENTANONE AND AN INTERMEDIATE USEFUL THEREFOR BASF AKTIENGESELLSCHAFT (DE) 2002-01-03 WO claimed

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-20020013489-A1 Process for the preparation of 2,2-dimethyl-5-(4-chlorobenzyl) cyclopentanone and an intermediate useful therefore CYP51A1, CYP4B1, CYP1B1 MAOB 931/4885TSHR 4792/4885TRPA1 4698/4885

“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.