SCHEMBL2275652

SCHEMBL2275652

COC(=O)c1ccc(-c2ccc(C)cc2)cc1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.87
MAPT P10636 5/20 0.67
ALDH1A1 P00352 4/20 0.67
CA1 P00915 4/20 0.59
CA2 P00918 4/20 0.59
CA12 O43570 3/20 0.59
CA9 Q16790 3/20 0.59
CA14 Q9ULX7 3/20 0.59
CA7 P43166 1/20 0.59
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
NPC1 O15118 2/20 0.56
HPGD P15428 2/20 0.56
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
TSHR P16473 1/20 0.56
PTPN1 P18031 1/20 0.54
EGFR P00533 1/20 0.53
ERN1 O75460 1/20 0.53
KDM4E B2RXH2 1/20 0.53

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
SCHEMBL16604879 1.00 TDP1 (0.87) TDP1MAPTALDH1A1CA1CA2
SCHEMBL13019491 1.00 TDP1 (0.87) TDP1MAPTALDH1A1CA1CA2
SCHEMBL16769662 0.94 TDP1 (0.77) TDP1MAPTALDH1A1CA1CA2
4-Methylbenzoic Acid Methyl Ester SCHEMBL10539663 0.93 TDP1 (1.00) TDP1MAPTALDH1A1CA1CA2
4-Methylbenzoic Acid Methyl Ester SCHEMBL137891 0.93 TDP1 (1.00) TDP1MAPTALDH1A1CA1CA2
SCHEMBL16140272 0.92 TDP1 (0.80) TDP1MAPTALDH1A1CA1CA2
Biphenyl Dimethyl Dicarboxylate SCHEMBL68521 0.91 CA1 (0.70) TDP1MAPTALDH1A1CA1CA2
SCHEMBL19387238 0.91 CA1 (0.70) TDP1MAPTALDH1A1CA1CA2
SCHEMBL14346590 0.89 TDP1 (0.69) TDP1MAPTALDH1A1CA1CA2
SCHEMBL14346594 0.89 TDP1 (0.69) TDP1MAPTALDH1A1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4275759-A2 QUINOLINE DERIVATIVES AS CHROMOBOX (CBX) PROTEIN INHIBITORS FOR TREATING CANCER Dana-Farber Cancer Institute, Inc. (US) 2023-11-15 EP disclosed
EP-3515449-B1 QUINOLINE DERIVATIVES AS CHROMOBOX (CBX) PROTEIN INHIBITORS FOR TREATING CANCER DANA FARBER CANCER INST INC (US) 2023-07-12 EP disclosed
US-11485721-B2 Method for the metal-free preparation of a biaryl by a photosplicing reaction and their uses Leibniz-Institut für Naturstoff-Forschung und Infektionsbiologie e. V. Hans-Knöll-Institut (DE) 2022-11-01 US disclosed
US-11485721-B2 Method for the metal-free preparation of a biaryl by a photosplicing reaction and their uses Leibniz-Institut für Naturstoff-Forschung und Infektionsbiologie e. V. Hans-Knöll-Institut (DE) 2022-11-01 US disclosed
WO-2021236491-A1 BENZOYLHYDRAZIDE-DERIVED HDAC DEGRADERS AS THERAPEUTICS FOR TREATING CANCER AND OTHER HUMAN DISEASES UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2021-11-25 WO disclosed
US-20200339529-A1 METHOD FOR THE METAL-FREE PREPARATION OF A BIARYL BY A PHOTOSPLICING REACTION AND THEIR USES LEIBNIZ-INSTITUT FÜR NATURSTOFF-FORSCHUNG UND INFEKTIONSBIOLOGIE E.V. HANS-KNÖLL-INSTITUT (HKI) (DE) 2020-10-29 US disclosed
US-20200339529-A1 METHOD FOR THE METAL-FREE PREPARATION OF A BIARYL BY A PHOTOSPLICING REACTION AND THEIR USES LEIBNIZ-INSTITUT FÜR NATURSTOFF-FORSCHUNG UND INFEKTIONSBIOLOGIE E.V. HANS-KNÖLL-INSTITUT (HKI) (DE) 2020-10-29 US disclosed
EP-3541892-B1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME MERCK PATENT GMBH (DE) 2020-10-21 EP disclosed
US-10738242-B2 Compound, cured product, polymer, photo-alignment film, optically anisotropic body and liquid crystal display element DIC CORPORATION (JP) 2020-08-11 US disclosed
US-20200031731-A1 Gold-Catalyzed C-C Cross-Coupling of Boron- and Silicon-Containing Aryl Compounds and Aryldiazonium Compounds by Visible-Light Universität Heidelberg (DE) 2020-01-30 US disclosed
US-20080116419-A1 Mesogenic Compounds, Liquid Crystal Medium and Liquid Crystal Display MERCK PATENT GMBH (DE) 2008-05-22 US disclosed
US-20080116419-A1 Mesogenic Compounds, Liquid Crystal Medium and Liquid Crystal Display MERCK PATENT GMBH (DE) 2008-05-22 US disclosed
EP-1833978-A1 TRIPEPTIDE AND TETRAPEPTIDE THIOETHERS TELIK, INC. (US) 2007-09-19 EP disclosed
US-7169325-B2 Liquid crystalline compound, liquid crystalline composition and retardation film FUJI PHOTO FILM CO., LTD. (JP) 2007-01-30 US disclosed
EP-1739151-A1 Mesogenic compounds, liquid crystal medium and liquid display MERCK PATENT GmbH (DE) 2007-01-03 EP disclosed
US-7129215-B2 Tripeptide and tetrapeptide thioethers TELIK, INC. (US) 2006-10-31 US disclosed
US-20060160749-A1 TRIPEPTIDE AND TETRAPEPTIDE THIOETHERS TELIK, INC. 2006-07-20 US disclosed
WO-2006074249-A1 TRIPEPTIDE AND TETRAPEPTIDE THIOETHERS TELIK, INC. (US) 2006-07-13 WO disclosed
US-6194599-B1 Process for preparing biaryl compounds CATALYTICA, INC. 2001-02-27 US disclosed
US-5922898-A Process for preparing biaryl compounds CATALYTICA PHARMACEUTICALS, INC. (US) 1999-07-13 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 (6 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-20060160749-A1 TRIPEPTIDE AND TETRAPEPTIDE THIOETHERS MCL1, THPO, MYADM TDP1 2718/4885MAPT 3983/4885ALDH1A1 3287/4885
US-11485721-B2 Method for the metal-free preparation of a biaryl by a photosplicing reaction and their uses CBR3, POR, CYP2F1 TDP1 4859/4885MAPT 3454/4885ALDH1A1 809/4885
US-20200339529-A1 METHOD FOR THE METAL-FREE PREPARATION OF A BIARYL BY A PHOTOSPLICING REACTION AND THEIR USES CBR3, POR, CYP2F1 TDP1 4859/4885MAPT 3454/4885ALDH1A1 809/4885
US-10738242-B2 Compound, cured product, polymer, photo-alignment film, optically anisotropic body and liquid crystal display element PYM1, ZYX, CRY1 TDP1 3029/4885MAPT 2680/4885ALDH1A1 2197/4885
US-20080116419-A1 Mesogenic Compounds, Liquid Crystal Medium and Liquid Crystal Display CRY1, CRY2, IK TDP1 4017/4885MAPT 361/4885ALDH1A1 2978/4885
US-20200031731-A1 Gold-Catalyzed C-C Cross-Coupling of Boron- and Silicon-Containing Aryl Compounds and Aryldiazonium Compounds by Visible-Light HCCS, AHR, CTRC TDP1 4458/4885MAPT 2245/4885ALDH1A1 1110/4885

“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.