SCHEMBL4199931

SCHEMBL4199931

CC(C)(C1CCCCC1)C1CCC(O)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
EPHX1 P07099 1/20 0.35
SSTR4 P31391 2/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
ALOX12 P18054 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
SHBG P04278 1/20 0.30

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
SCHEMBL8710279 1.00 TSHR (0.43) TSHREPHX1SSTR4MEN1ALDH1A1
SCHEMBL18498 0.89 TSHR (0.37) TSHRSHBG
SCHEMBL30928250 0.89 TSHR (0.37) TSHRSHBG
SCHEMBL9815710 0.89 TSHR (0.37) TSHRSHBG
SCHEMBL19809440 0.87 EPHX1 (0.37) EPHX1SSTR4MEN1ALDH1A1LMNA
SCHEMBL9815654 0.86 TSHR (0.33) TSHR
SCHEMBL25941432 0.85 TSHR (0.43) TSHREPHX1SSTR4MEN1ALDH1A1
SCHEMBL133604 0.84 EPHX1 (0.33) EPHX1SSTR4MEN1ALDH1A1LMNA
SCHEMBL29024831 0.84 EPHX1 (0.33) EPHX1SSTR4MEN1ALDH1A1LMNA
SCHEMBL9016315 0.84 EPHX1 (0.33) EPHX1SSTR4MEN1ALDH1A1LMNA

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115197049-B Method for refining and purifying hydrogenated bisphenol A 中国石油化工股份有限公司 2024-11-22 CN disclosed
CN-115197049-A Method for refining and purifying hydrogenated bisphenol A 中国石油化工股份有限公司 2022-10-18 CN disclosed
EP-2966060-A1 ISOTHIOCYANATE PRODUCTION METHOD, COMPOSITION FOR TRANSPORTING AND STORING N-SUBSTITUTED O-SUBSTITUTED THIOCARBAMATE, AND ISOTHIOCYANATE COMPOSITION Asahi Kasei Chemicals Corporation (JP) 2016-01-13 EP disclosed
CN-101035833-B Cyclohexene oxide compound with cyclohexyl or long-chain alkyl and application thereof TOAGOSEI CO LTD 2010-09-01 CN disclosed
US-7612123-B2 Cyclohexene oxide compound having cyclohexyl group or long-chain alkyl group, and use thereof TOAGOSEI CO., LTD. (JP) 2009-11-03 US disclosed
EP-1798251-B1 CYCLOHEXENE OXIDE COMPOUND HAVING CYCLOHEXYL GROUP OR BRANCHED LONG-CHAIN ALKYL GROUP AND USE THEREOF TOAGOSEI CO LTD (JP) 2009-02-25 EP disclosed
US-20080108725-A1 Cyclohexene Oxide Compound Having Cyclohexyl Group or Long-Chain Alkyl Group, and Use Thereof TOAGOSEI CO., LTD. (JP) 2008-05-08 US disclosed
CN-101035833-A Cyclohexene oxide compound with cyclohexyl or long-chain alkyl and application thereof TOAGOSEI CO LTD (JP) 2007-09-12 CN disclosed
EP-1798251-A1 CYCLOHEXENE OXIDE COMPOUND HAVING CYCLOHEXYL GROUP OR LONG-CHAIN ALKYL GROUP AND USE THEREOF TOAGOSEI CO., LTD. (JP) 2007-06-20 EP disclosed
US-5723450-A Substituted pyridines, their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1998-03-03 US disclosed
US-4187152-A Extractive distillation for separating ketones and/or alcohols from phenol and/or cresol ALLIED CHEMICAL CORPORATION (US) 1980-02-05 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-20080108725-A1 Cyclohexene Oxide Compound Having Cyclohexyl Group or Long-Chain Alkyl Group, and Use Thereof RAD51, HEATR1, DCXR TSHR 3435/4885EPHX1 492/4885SSTR4 1836/4885

“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.