SCHEMBL1003111

SCHEMBL1003111

O=C(CC(=O)c1ccc2ccccc2c1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.65
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
SMN1; SMN2 Q16637 4/20 0.65
HPGD P15428 4/20 0.65
MAPT P10636 3/20 0.65
CYP3A4 P08684 3/20 0.65
CES1 P23141 2/20 0.65
ALOX15 P16050 2/20 0.65
MAPK1 P28482 2/20 0.65
TDP1 Q9NUW8 2/20 0.65
PTPN1 P18031 2/20 0.65
ALDH1A1 P00352 4/20 0.59
LMNA P02545 1/20 0.59
CES2 O00748 1/20 0.59
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
HDAC1 Q13547 2/20 0.55
HDAC8 Q9BY41 1/20 0.55
PLOD2 O00469 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
SCHEMBL29483367 1.00 KDM4E (0.65) KDM4EMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL2038455 0.94 MEN1 (0.63) KDM4EMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL29489791 0.94 PTPN1 (0.71) KDM4EMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL1974978 0.94 PTPN1 (0.71) KDM4EMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL28972866 0.93 PTPN1 (0.57) KDM4EMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL1082898 0.93 PTPN1 (0.57) KDM4EMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL28972869 0.93 PTPN1 (0.57) KDM4EMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL6061644 0.89 MEN1 (0.61) KDM4EMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL3373461 0.89 PTPN1 (0.65) KDM4EMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL2033968 0.88 MEN1 (0.55) KDM4EMEN1KMT2ASMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119462527-A Visible light promotion I2Catalytic C (sp)3) Method for synthesizing 2-benzoyl quinazoline-4 (3H) -ketone by virtue of amination reaction of (E) -H 桂林理工大学 2025-02-18 CN disclosed
CN-111333560-B Method for preparing spiro beta-lactam 合肥工业大学 2024-01-23 CN disclosed
CN-109776293-B Method for preparing 1, 3-diketone compound from alkynone 温州大学 2022-04-05 CN disclosed
US-20210015726-A1 TITANIUM DIOXIDE VENATOR GERMANY GMBH (DE) 2021-01-21 US disclosed
US-9874566-B2 Compositions and methods for making and using oxygen sensing nanofibers and scaffolds UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2018-01-23 US disclosed
US-9874566-B2 Compositions and methods for making and using oxygen sensing nanofibers and scaffolds UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2018-01-23 US disclosed
US-20160041177-A1 COMPOSITIONS AND METHODS FOR MAKING AND USING OXYGEN SENSING NANOFIBERS AND SCAFFOLDS Univ Virginia Patent Found (US) 2016-02-11 US disclosed
US-20160041177-A1 COMPOSITIONS AND METHODS FOR MAKING AND USING OXYGEN SENSING NANOFIBERS AND SCAFFOLDS Univ Virginia Patent Found (US) 2016-02-11 US disclosed
US-9074129-B2 Mechanochromic luminescent difluoroboron beta-diketonates UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2015-07-07 US disclosed
US-9074129-B2 Mechanochromic luminescent difluoroboron beta-diketonates UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2015-07-07 US disclosed
US-20050272794-A1 Pyrazole derivatives, compositions containing such compounds and methods of use MERCK SHARP & DOHME LLC 2005-12-08 US disclosed
US-6096144-A TREATING WITH ACIDIC OR ALKALINE SOLUTION OF CONJUGATED UNSATURATED COMPOUND WITH AT LEAST 5 BONDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-08-01 US disclosed
US-5858571-A TREATING A PULVERIZED HYDROGEN ABSORBING ALLOY WITH A SOLUTION COMPRISING A CONJUGATED UNSATURATED COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-01-12 US disclosed
US-5433896-A FLUORESCENT MOLECULAR PROBES, INC. (US) 1995-07-18 US disclosed
CN-1006386-B PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER SHINETSU CHEM IND CO (JP) 1990-01-10 CN disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
CN-85107531-A Process for producing vinyl chloride polymer 1987-01-21 CN disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP 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-20050272794-A1 Pyrazole derivatives, compositions containing such compounds and methods of use PC, GOT2, PNLIP KDM4E 4338/4885MEN1 3060/4885KMT2A 4218/4885
US-20210015726-A1 TITANIUM DIOXIDE TYR, CUTA, TSLP KDM4E 2239/4885MEN1 2573/4885KMT2A 2413/4885
US-20160041177-A1 COMPOSITIONS AND METHODS FOR MAKING AND USING OXYGEN SENSING NANOFIBERS AND SCAFFOLDS ILK, HIF1A, TNNI3 KDM4E 4209/4885MEN1 3310/4885KMT2A 4810/4885

“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.