SCHEMBL199413

SCHEMBL199413

CC(C)c1cccc(C(C)C)c1[O]

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.57
GABRG2 P18507 2/20 0.57
GABRB3 P28472 2/20 0.57
GABRB2 P47870 2/20 0.57
LMNA P02545 2/20 0.57
FAAH O00519 2/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
HPGD P15428 1/20 0.57
TSHR P16473 1/20 0.57
GABRB1 P18505 1/20 0.57
PTGS1 P23219 1/20 0.57
SLC6A2 P23975 1/20 0.57
HTR2C P28335 1/20 0.57
GABRA5 P31644 1/20 0.57
GABRA3 P34903 1/20 0.57
HTR2B P41595 1/20 0.57
GABRA2 P47869 1/20 0.57

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
SCHEMBL1808716 0.87 GABRA1 (0.46) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL1274717 0.82 GABRA1 (0.41) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL8577809 0.82 LPAR1 (0.47) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL22686111 0.80 GABRA1 (0.44) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL396706 0.79 GABRA1 (0.52) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL3191750 0.79 GABRA1 (0.55) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL1318524 0.79 GABRA1 (0.55) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL16711702 0.78 GABRA1 (0.39) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL997260 0.78 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL2049100 0.78 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115246905-B Olefin polymerization catalyst, olefin polymerization catalyst component, polymerization method and application thereof 中国石油化工股份有限公司 2024-02-13 CN claimed
CN-115246905-A Olefin polymerization catalyst and olefin polymerization catalyst component, and polymerization method and application thereof 中国石油化工股份有限公司 2022-10-28 CN claimed
CN-111715293-A Complex used as active component in supported type epoxidation catalyst 利安德化学技术有限公司 2020-09-29 CN claimed
US-9924721-B2 Malonic ester derivatives of heteroarylpiperidines and -piperazines as fungicides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-03-27 US claimed
EP-3169436-A2 COMPLEXES USEFUL AS ACTIVE COMPONENTS IN SUPPORTED EPOXIDATION CATALYSTS Lyondell Chemical Technology, L.P. (US) 2017-05-24 EP claimed
CN-106536049-A Complex used as active component in supported type epoxidation catalyst 利安德化学技术有限公司 2017-03-22 CN claimed
US-9593134-B2 Complexes useful as active components in supported epoxidation catalysts LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) 2017-03-14 US claimed
US-9499455-B2 Process for the selective dimerisation of ethylene to 1-butene IFP Energies Nouvelles (FR) 2016-11-22 US claimed
US-20160198713-A1 Malonic ester derivatives of heteroarylpiperidines and -piperazines as fungicides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-07-14 US claimed
EP-3039023-A1 MALONIC ESTER DERIVATIVES OF HETEROARYLPIPERIDINES AND -PIPERAZINES AS FUNGICIDES Bayer CropScience Aktiengesellschaft (DE) 2016-07-06 EP claimed
CN-105705503-A Malonic ester derivatives of heteroarylpiperidines and -piperazines as fungicides 拜耳作物科学股份公司 2016-06-22 CN claimed
US-20160016157-A1 COMPLEXES USEFUL AS ACTIVE COMPONENTS IN SUPPORTED EPOXIDATION CATALYSTS LYONDELL CHEMICAL TECHNOLOGY, L.P. 2016-01-21 US claimed
WO-2016011276-A2 COMPLEXES USEFUL AS ACTIVE COMPONENTS IN SUPPORTED EPOXIDATION CATALYSTS LYONDELL CHEMICAL TECHNOLOGY, L.P. (US) 2016-01-21 WO claimed
WO-2015028457-A1 MALONIC ESTER DERIVATIVES OF HETEROARYLPIPERIDINES AND -PIPERAZINES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2015-03-05 WO claimed
US-6903042-B2 Catalytic composition and process for oligomerizing ethylene, in particular to 1-hexene INSTITUT FRANCAIS DU PETROLE (FR) 2005-06-07 US claimed
CN-1164247-A Process for polymerizing cycloolefins and photopolymerizable composition CIBA GEIGY AG (CH) 1997-11-05 CN claimed
CN-1164248-A Polymerizable composition and process for polymerizing cyclical olefins CIBA GEIGY AG (CH) 1997-11-05 CN claimed
US-20240239725-A1 METHOD FOR OLIGOMERISATION IN A REACTOR COMPRISING VARIABLE-DIAMETER ZONES, INCLUDING A STEP OF RECYCLING A PRE-COOLED SOLVENT IFP Energies Nouvelles (FR) 2024-07-18 US disclosed
EP-0280938-A1 Antioxidant aromatic fluorophosphites ALBEMARLE CORPORATION (US) 1988-09-07 EP disclosed
US-4710549-A Cross-linked phosphazene polymer ETHYL CORPORATION (US) 1987-12-01 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-20160198713-A1 Malonic ester derivatives of heteroarylpiperidines and -piperazines as fungicides ME1, CYP1A1, CYP1A2 GABRA1 1133/4885GABRG2 387/4885GABRB3 2684/4885
US-20160016157-A1 COMPLEXES USEFUL AS ACTIVE COMPONENTS IN SUPPORTED EPOXIDATION CATALYSTS SCO2, MPO, EPOR GABRA1 3593/4885GABRG2 3252/4885GABRB3 4002/4885
US-20240239725-A1 METHOD FOR OLIGOMERISATION IN A REACTOR COMPRISING VARIABLE-DIAMETER ZONES, INCLUDING A STEP OF RECYCLING A PRE-COOLED SOLVENT PRPF40A, NSF, NOD2 GABRA1 2348/4885GABRG2 2534/4885GABRB3 1916/4885

“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.