SCHEMBL112587

SCHEMBL112587

Cc1cccc(O)c1C(C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.58
ATM Q13315 2/20 0.58
GABRA1 P14867 1/20 0.50
GABRB2 P47870 1/20 0.50
ALDH1A1 P00352 5/20 0.46
TDP1 Q9NUW8 3/20 0.44
TSHR P16473 2/20 0.44
CA2 P00918 4/20 0.41
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
ESR1 P03372 3/20 0.38
HPGD P15428 3/20 0.38
HSD17B10 Q99714 3/20 0.38
ESR2 Q92731 2/20 0.38
EGFR P00533 2/20 0.38
LMNA P02545 2/20 0.38
FYN P06241 2/20 0.38
MMP9 P14780 2/20 0.38
ALOX15 P16050 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
SCHEMBL29664137 1.00 TRPA1 (0.58) TRPA1ATMGABRA1GABRB2ALDH1A1
SCHEMBL6473329 0.86 TRPA1 (0.58) TRPA1ATMGABRA1GABRB2ALDH1A1
SCHEMBL419708 0.85 ALDH1A1 (0.52) TRPA1ATMGABRA1GABRB2ALDH1A1
SCHEMBL8387574 0.82 GABRA1 (0.48) TRPA1ATMGABRA1GABRB2ALDH1A1
SCHEMBL2687017 0.82 GABRA1 (0.48) TRPA1ATMGABRA1GABRB2ALDH1A1
Pyrogallol SCHEMBL6035335 0.81 TRPA1 (0.48) TRPA1ATMGABRA1GABRB2ALDH1A1
SCHEMBL2446676 0.79 TRPA1 (0.56) TRPA1ATMGABRA1GABRB2ALDH1A1
SCHEMBL2492055 0.79 TRPA1 (0.44) TRPA1ATMGABRA1GABRB2ALDH1A1
SCHEMBL30503586 0.79 TRPA1 (0.56) TRPA1ATMGABRA1GABRB2ALDH1A1
SCHEMBL17758292 0.79 TRPA1 (0.50) TRPA1ATMGABRA1GABRB2ALDH1A1

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 1481 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119769515-B Validamycin-containing composition Compound pesticide and application thereof 浙江省桐庐汇丰生物科技有限公司 2025-05-30 CN claimed
CN-119769515-A Validamycin-containing composition Compound pesticide and application thereof 浙江省桐庐汇丰生物科技有限公司 2025-04-08 CN claimed
CN-119529785-B Aggravated high-temperature-resistant high-salt-resistant gel and preparation method and application thereof 成都西油华巍科技有限公司 2025-04-08 CN claimed
CN-119529785-A Aggravated high-temperature-resistant high-salt-resistant gel and preparation method and application thereof 成都西油华巍科技有限公司 2025-02-28 CN claimed
CN-118931585-A Preparation process for extracting ship fuel oil from inferior oil 山东众泰石油化工有限责任公司 2024-11-12 CN claimed
CN-118496065-A Continuous process and device for producing cresol by thermal decomposition and tert-butyl removal of tert-butyl cresol 湖南新岭化工股份有限公司 2024-08-16 CN claimed
WO-2024134058-A1 FUEL COMPOSITION COMPRISING A RENEWABLE BASE, A FATTY ACID ESTER AND AN ALKYL-PHENOL ADDITIVE TOTALENERGIES ONETECH (FR) 2024-06-27 WO claimed
EP-4065671-B1 USE OF ALKYL PHENOL COMPOUNDS AS DETERGENT ADDITIVES FOR PETROLS TOTALENERGIES ONETECH (FR) 2024-06-05 EP claimed
EP-4373903-A1 USE OF A COMPOSITION OF ADDITIVES FOR REDUCING DIESEL VEHICLE EMISSIONS TotalEnergies OneTech (FR) 2024-05-29 EP claimed
CN-116997253-A Space insect repellent composition S.C.庄臣父子公司 2023-11-03 CN claimed
WO-1997025372-A1 FLAME RETARDANT COMPOSITION KUCKRO GERARD W (US) 1997-07-17 WO claimed
WO-1996010929-A1 CIGARETTE FILTERS AND THE LIKE G.L.A.D. S.A. (LU) 1996-04-18 WO claimed
EP-0215010-B1 INSECTICIDAL COMPOSITION COMPRISING MORE THAN ONE ACTIVE INGREDIENTS CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1990-04-11 EP claimed
EP-0208758-B1 PYRETHROIDAL COMPOSITION COMPRISING MORE THAN ONE ACTIVE INGREDIENTS CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1989-08-16 EP claimed
EP-0251711-A2 Thermoplastic polyester resin composition POLYPLASTICS CO. LTD. (JP) 1988-01-07 EP claimed
EP-0251712-A2 Thermoplastics polyester resin composition POLYPLASTICS CO. LTD. (JP) 1988-01-07 EP claimed
US-4473484-A PHOTOISOMERIZABLE MATERIAL, PHOTOSENSITIZER, AND BY-PRODUCT INHIBITOR AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) 1984-09-25 US claimed
EP-0055473-A1 Resin compositions SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-07-07 EP claimed
US-4247446-A CROSSLINKED POLYOLEFIN, DECABROMODIPHENYL ETHER, SILICONE GUM, ANTIMONY OXIDE, SILICA, ORGANIC LEAD SALT GENERAL ELECTRIC COMPANY (US) 1981-01-27 US claimed
US-3963458-A ELASTOMERIC SUPERSIZE LAYER CONTAINING ANTIOXIDANT NORTON COMPANY (US) 1976-06-15 US claimed