SCHEMBL2051069

SCHEMBL2051069

Cc1ccc(O)c(C)c1C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.46
ATM Q13315 1/20 0.46
ESR1 P03372 5/20 0.41
ALDH1A1 P00352 6/20 0.38
TDP1 Q9NUW8 4/20 0.38
ALOX15 P16050 4/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 1/20 0.38
NR1I2 O75469 1/20 0.37
LMNA P02545 1/20 0.37
CYP2C9 P11712 1/20 0.37
MIF P14174 1/20 0.37
TYR P14679 1/20 0.37
HTT P42858 1/20 0.37
NFE2L2 Q16236 1/20 0.37
TP53 P04637 2/20 0.36
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
ESR2 Q92731 4/20 0.35
SCN5A Q14524 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
SCHEMBL30438308 1.00 TRPA1 (0.46) TRPA1ATMESR1ALDH1A1TDP1
SCHEMBL4483852 0.85 TRPA1 (0.44) TRPA1ATMESR1ALDH1A1TDP1
SCHEMBL29359879 0.83 ESR1 (0.43) TRPA1ATMESR1ALDH1A1TDP1
SCHEMBL36472 0.83 ESR1 (0.43) TRPA1ATMESR1ALDH1A1TDP1
SCHEMBL8890931 0.81 ESR1 (0.41) TRPA1ATMESR1ALDH1A1TDP1
SCHEMBL394780 0.81 TRPA1 (0.46) TRPA1ATMESR1ALDH1A1TDP1
SCHEMBL30628003 0.81 TRPA1 (0.46) TRPA1ATMESR1ALDH1A1TDP1
SCHEMBL1053673 0.81 ESR1 (0.41) TRPA1ATMESR1ALDH1A1TDP1
SCHEMBL30799097 0.79 ALDH1A1 (0.45) TRPA1ATMESR1ALDH1A1TDP1
SCHEMBL245349 0.79 ALDH1A1 (0.45) TRPA1ATMESR1ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115784996-A Synthetic method and application of oxymetazoline hydrochloride 南京海鲸药业股份有限公司 2023-03-14 CN claimed
EP-1829952-B1 LUBRICATING OIL COMPOSITION FOR AN INTERNAL COMBUSTION ENGINE IDEMITSU KOSAN CO (JP) 2014-10-01 EP claimed
US-4137202-A OBTAINING FREE-FLOWING PVC BY DISSOLVING ETHYLENE-VINYL ESTER COPOLYMER IN THE VINYL CHLORIDE BEFORE POLYMERIZATION DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) 1979-01-30 US claimed
CN-120192215-A Process for preparing phenol products from 2, 4-xylenol/2, 5-xylenol 陕西巴斯腾科技有限公司 2025-06-24 CN disclosed
CN-112679635-B Preparation method of supported metallocene catalyst and catalyst prepared by preparation method 中国石油化工股份有限公司 2024-03-26 CN disclosed
CN-112638975-B Method for reducing aldehyde emissions in polyurethane foams 陶氏环球技术有限责任公司 2023-05-16 CN disclosed
US-20230132285-A1 PROCESS FOR INHIBITING THE UNDESIRED FREE-RADICAL POLYMERIZATION OF ACRYLIC ACID PRESENT IN A LIQUID PHASE P BASF SE (DE) 2023-04-27 US disclosed
CN-115784996-A Synthetic method and application of oxymetazoline hydrochloride 南京海鲸药业股份有限公司 2023-03-14 CN disclosed
WO-2021133188-A1 COMPOSITION FOR STABILIZING LATEX AND METHOD FOR PRODUCING SAME ПУБЛИЧНОЕ АКЦИОНЕРНОЕ ОБЩЕСТВО "СИБУР ХОЛДИНГ" (ПАО "СИБУР ХОЛДИНГ") 2021-07-01 WO disclosed
CN-110450554-A Raster print method SHENZHEN KAILICHENG IND DEVELOPMENT CO LTD 2019-11-15 CN disclosed
EP-2557131-B1 ANTIFOULING COATING COMPOSITION, METHOD FOR PRODUCING ANTIFOULING COATING FILM, AND ANTIFOULING COATING FILM MITSUBISHI CHEM CORP (JP) 2019-05-29 EP disclosed
US-20060054859-A1 Liquid-crystalline (METH) acrylate derivatives and composition containing them JNC PETROCHEMICAL CORPORATION (JP) 2006-03-16 US disclosed
WO-2006005711-A1 LUBRICATING OIL COMPOSITION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2006-01-19 WO disclosed
US-6552130-B1 Used as a covering material for civil engineering and construction applications MITSUBISHI RAYON CO., LTD. (JP) 2003-04-22 US disclosed
EP-1152014-A1 RESIN COMPOSITION Mitsubishi Rayon Co., Ltd. (JP) 2001-11-07 EP disclosed
US-4942107-A Image-forming material and image recording method using the same FUJI PHOTO FILM CO., LTD. (JP) 1990-07-17 US disclosed
EP-0374576-A2 Polymerization of heat-treated reaction product of dicyclopentadiene and elastomer NIPPON ZEON CO., LTD. (JP) 1990-06-27 EP disclosed
US-4267084-A MOLDING MATERIALS COMPRISING AN ALKYL MERCAPTAN-MODIFIED VINYL CHLORIDE POLYMER AND ANOTHER VINYL CHLORIDE POLYMER, HEAT RESISTANCE; PROCESS CONTROL TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1981-05-12 US disclosed
EP-0008321-A2 Vinylchloride bulk polymerisation process HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) 1980-03-05 EP disclosed
US-4137202-A OBTAINING FREE-FLOWING PVC BY DISSOLVING ETHYLENE-VINYL ESTER COPOLYMER IN THE VINYL CHLORIDE BEFORE POLYMERIZATION DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) 1979-01-30 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 (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-20230132285-A1 PROCESS FOR INHIBITING THE UNDESIRED FREE-RADICAL POLYMERIZATION OF ACRYLIC ACID PRESENT IN A LIQUID PHASE P GRHPR, MPHOSPH6, ALAD TRPA1 2439/4885ATM 237/4885ESR1 4009/4885

“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.