SCHEMBL5046947

SCHEMBL5046947

Cc1ccccc1C(C)(C)[O]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
ACHE P22303 2/20 0.45
GABRA1 P14867 1/20 0.43
GABRB2 P47870 1/20 0.43
ALDH1A1 P00352 4/20 0.42
TDP1 Q9NUW8 2/20 0.37
CASR P41180 1/20 0.37
CA2 P00918 2/20 0.36
CA1 P00915 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CYP3A4 P08684 1/20 0.35
HSD17B10 Q99714 1/20 0.34
HPGD P15428 1/20 0.34
CYP1A2 P05177 2/20 0.33
CYP2A6 P11509 2/20 0.33
TRPA1 O75762 1/20 0.33
ATM Q13315 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL5526684 0.81 TSHR (0.47) TSHRACHEGABRA1GABRB2ALDH1A1
SCHEMBL2653650 0.80 TRPA1 (0.46) TSHRACHEGABRA1GABRB2ALDH1A1
SCHEMBL41854 0.79 TSHR (0.45) TSHRACHEGABRA1GABRB2ALDH1A1
SCHEMBL30407772 0.78 GABRA1 (0.58) TSHRACHEGABRA1GABRB2ALDH1A1
SCHEMBL5496813 0.78 GABRA1 (0.58) TSHRACHEGABRA1GABRB2ALDH1A1
SCHEMBL8784146 0.78 TSHR (0.50) TSHRACHEGABRA1GABRB2ALDH1A1
SCHEMBL30337376 0.78 TSHR (0.50) TSHRACHEGABRA1GABRB2ALDH1A1
SCHEMBL19468131 0.78 TSHR (0.50) TSHRACHEGABRA1GABRB2ALDH1A1
SCHEMBL1945388 0.78 TSHR (0.50) TSHRACHEGABRA1GABRB2ALDH1A1
SCHEMBL542212 0.78 GABRA1 (0.58) TSHRACHEGABRA1GABRB2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024150793-A1 POLYCRYSTALLINE FORM OF BIPHENOL DIGLYCIDYL ETHER, AND RESIN COMPOSITION CONTAINING SAID POLYCRYSTALLINE FORM AND CURED PRODUCT THEREOF 三菱ケミカル株式会社 2024-07-18 WO disclosed
CN-118055961-A Method for producing epoxy resin, epoxy resin composition, cured product, and electric/electronic component 三菱化学株式会社 2024-05-17 CN disclosed
CN-117957264-A Resin composition, cured product, resin sheet, insulating layer, electric/electronic component, printed wiring board, and curing agent for epoxy resin 三菱化学株式会社 2024-04-30 CN disclosed
WO-2024071129-A1 ACTIVE ESTER RESIN, EPOXY RESIN COMPOSITION AND CURED PRODUCT THEREOF, PREPREG, LAMINATED BOARD, AND BUILD-UP FILM 日鉄ケミカル&マテリアル株式会社 2024-04-04 WO disclosed
US-11807711-B2 Phenoxy resin, resin composition including same, cured object obtained therefrom, and production method therefor NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-11-07 US disclosed
CN-116075529-A Method for producing aromatic ether compound having vinyl group 日铁化学材料株式会社 2023-05-05 CN disclosed
WO-2023053875-A1 MODIFIED EPOXY RESIN, RESIN COMPOSITION, CURED OBJECT, LAMINATE FOR ELECTRICAL/ELECTRONIC CIRCUIT, AND METHOD FOR PRODUCING MODIFIED EPOXY RESIN 日鉄ケミカル&マテリアル株式会社 2023-04-06 WO disclosed
US-20230097650-A1 ACTIVE ESTER RESIN, METHOD FOR PRODUCING THEREOF, EPOXY RESIN COMPOSITION, CURED PRODUCT THEREOF, PREPREG, LAMINATED BOARD, AND MATERIAL FOR CIRCUIT SUBSTRATE NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-03-30 US disclosed
WO-2023048209-A1 RESIN COMPOSITION, CURED PRODUCT, RESIN SHEET, INSULATION LAYER, ELECTRIC/ELECTRONIC COMPONENT, PRINTED CIRCUIT BOARD, AND CURING AGENT FOR EPOXY RESIN 三菱ケミカル株式会社 2023-03-30 WO disclosed
WO-2023042650-A1 MODIFIED EPOXY RESIN, RESIN COMPOSITION, CURED ARTICLE, LAMINATED BOARD FOR ELECTRIC/ELECTRONIC CIRCUITS, AND METHOD FOR PRODUCING MODIFIED EPOXY RESIN 日鉄ケミカル&マテリアル株式会社 2023-03-23 WO disclosed
US-20030027902-A1 Piperazinone derivatives LAZZARI DARIO (IT) 2003-02-06 US disclosed
WO-2001062739-A2 THIOIMIDAZOLIDINE DERIVATIVES AS LIGHT STABILIZERS FOR POLYMERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-08-30 WO disclosed
US-6005116-A HAVE INHIBITION ACTIVITIES AGAINST TYPE A-MONOAMINE OXIDASE; TREATING OR PREVENTING DEPRESSION, PARKINSON'S DISEASE, ALZEHEIMER'S DEMENTIA, OR CEREBROVASCULAR DEMENTIA SANKYO COMPANY, LIMITED (JP) 1999-12-21 US disclosed
EP-0885891-A1 ISOXAZOLE DERIVATIVES SANKYO COMPANY LIMITED (JP) 1998-12-23 EP disclosed
EP-0700390-B1 INTERMEDIATES AND METHODS FOR THE SYNTHESIS OF ANTHRAPYRAZOLONE ANTICANCER AGENTS DU PONT MERCK PHARMA (US) 1998-11-18 EP disclosed
US-5618944-A Method for the synthesis of anthrapyrazolones THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1997-04-08 US disclosed
EP-0700390-A1 INTERMEDIATES AND METHODS FOR THE SYNTHESIS OF ANTHRAPYRAZOLONE ANTICANCER AGENTS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1996-03-13 EP disclosed
US-5393886-A Intermediates for the synthesis of anthrapyrazolone anticancer agents THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1995-02-28 US disclosed
WO-1994025441-A1 INTERMEDIATES AND METHODS FOR THE SYNTHESIS OF ANTHRAPYRAZOLONE ANTICANCER AGENTS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-11-10 WO disclosed
US-4871757-A PESTICIDES HOFFMANN-LA ROCHE INC. (US) 1989-10-03 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-20030027902-A1 Piperazinone derivatives H1-4, EIF4G1, GPX4 TSHR 4191/4885ACHE 3825/4885GABRA1 2385/4885

“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.