SCHEMBL726216

SCHEMBL726216

CCc1c(C)cccc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
CA1 P00915 4/20 0.44
CA2 P00918 4/20 0.44
CA7 P43166 3/20 0.44
CA9 Q16790 3/20 0.44
CA12 O43570 2/20 0.44
CA14 Q9ULX7 2/20 0.44
CA4 P22748 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
CYP3A4 P08684 2/20 0.40
TP53 P04637 2/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL28382164 0.86 TSHR (0.39) KDM4ECA1CA2CA7CA9
SCHEMBL1547302 0.86 CA1 (0.52) KDM4ECA1CA2CA7CA9
SCHEMBL4961769 0.83 ALOX5 (0.42) KDM4ECA1CA2CA7CA9
SCHEMBL14341464 0.82 ALOX5 (0.49) KDM4ECA1CA2CA7CA9
SCHEMBL696242 0.81 TP53 (0.43) KDM4ECA1CA2CA7CA9
SCHEMBL16954859 0.81 ALDH1A1 (0.45) KDM4EALDH1A1LMNAMAPTCYP1A2
SCHEMBL2380969 0.81 CA1 (0.42) KDM4ECA1CA2CA7CA9
SCHEMBL2424037 0.81 TAAR1 (0.42) KDM4ECA1CA2CA7CA9
SCHEMBL695730 0.81 CA1 (0.42) KDM4ECA1CA2CA7CA9
SCHEMBL14999450 0.80 ACHE (0.38) KDM4ECA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2960299-A1 POLYMER COMPOSITION AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL CO., LTD. (JP) 2015-12-30 EP claimed
EP-1894976-B1 POLYMER COMPOSITION AND POLYMER LIGHT-EMITTING DEVICE USING SAME SUMITOMO CHEMICAL CO (JP) 2015-09-30 EP claimed
US-9045613-B2 Polymer composition and polymer light-emitting device using same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-06-02 US claimed
JP-4729040-B2 2011-07-20 JP claimed
EP-1761574-A1 POLYMERIZATION PROCESS USING HYDROFLUOROCARBONS ExxonMobil Chemical Patents Inc. (US) 2007-03-14 EP claimed
WO-2006011868-A1 POLYMERIZATION PROCESSES USING HYDROFLUOROCARBONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-02-02 WO claimed
EP-3626802-B1 METHOD FOR PRODUCING LIQUID COMPOSITION SUMITOMO CHEMICAL CO (JP) 2024-12-25 EP disclosed
US-11787813-B2 Substituted pyrazolopyrimidines and substituted purines and their use as ubiquitin-specific-processing protease 1 (USP1) inhibitors KSQ Therapeutics, Inc. (US) 2023-10-17 US disclosed
US-20230203046-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AND SUBSTITUTED PURINES AND THEIR USE AS UBIQUITIN-SPECIFIC-PROCESSING PROTEASE 1 (USP1) INHIBITORS KSQ Therapeutics, Inc. 2023-06-29 US disclosed
US-20230041518-A1 QUINOLINE DERIVATIVES GILEAD SCIENCES, INC. 2023-02-09 US disclosed
EP-3898712-A1 PROCESS FOR THE PRODUCTION OF ISOOLEFIN POLYMERS USING A TERTIARY ETHER Arlanxeo Singapore Pte. Ltd. (SG) 2021-10-27 EP disclosed
US-11116760-B2 Quinoline derivatives GILEAD SCIENCES, INC. (US) 2021-09-14 US disclosed
US-11046886-B2 Method for producing liquid composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-06-29 US disclosed
US-7504417-B2 Substituted benzene derivatives or salts thereof ASTELLAS PHARMA INC. (JP) 2009-03-17 US disclosed
EP-1894976-A1 POLYMER COMPOSITION AND POLYMER LIGHT-EMITTING DEVICE USING SAME Sumitomo Chemical Company, Limited (JP) 2008-03-05 EP disclosed
EP-1572763-A4 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEM PATENTS INC (US) 2006-07-26 EP disclosed
EP-1572763-A2 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS ExxonMobil Chemical Patents Inc. (US) 2005-09-14 EP disclosed
WO-2004058825-A2 POLYMERS WITH NEW SEQUENCE DISTRIBUTIONS EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2004-07-15 WO disclosed
EP-0910573-A1 NEW AMINO ACID DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS Astra Aktiebolag (SE) 1999-04-28 EP disclosed
WO-1997046577-A1 NEW AMINO ACID DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS ASTRA AKTIEBOLAG (SE) 1997-12-11 WO 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 (4 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-11787813-B2 Substituted pyrazolopyrimidines and substituted purines and their use as ubiquitin-specific-processing protease 1 (USP1) inhibitors USP1, UPP1, USP2 KDM4E 825/4885CA1 3205/4885CA2 4388/4885
US-20230041518-A1 QUINOLINE DERIVATIVES CFTR, NQO1, IRF3 KDM4E 2522/4885CA1 4380/4885CA2 2460/4885
US-20230203046-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AND SUBSTITUTED PURINES AND THEIR USE AS UBIQUITIN-SPECIFIC-PROCESSING PROTEASE 1 (USP1) INHIBITORS USP1, UPP1, USP2 KDM4E 825/4885CA1 3205/4885CA2 4388/4885
US-11116760-B2 Quinoline derivatives CFTR, NQO1, IRF3 KDM4E 2522/4885CA1 4380/4885CA2 2460/4885

“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.