SCHEMBL220772

SCHEMBL220772

CCOc1[c]cc(OCC)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.54
TSHR P16473 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
LTA4H P09960 2/20 0.42
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
PARP10 Q53GL7 1/20 0.38
RELA Q04206 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ADRA2A P08913 2/20 0.37
MAPT P10636 1/20 0.37
NPC1 O15118 1/20 0.36

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
Magnesium Chloride Anhydrous SCHEMBL28223609 0.92 NQO1 (0.46) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL21268379 0.88 NQO1 (0.46) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL17046398 0.88 NQO1 (0.46) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL2454340 0.88 NQO1 (0.50) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL2893194 0.88 NQO1 (0.44) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL21268325 0.85 KDM4E (0.44) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL21268441 0.84 NQO1 (0.42) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL16950817 0.83 NQO1 (0.45) NQO1TSHRTDP1LTA4HKDM4E
SCHEMBL4915707 0.81 L3MBTL1 (0.44) NQO1TSHRTDP1ALDH1A1SMN1; SMN2
SCHEMBL15352558 0.81 NQO1 (0.39) NQO1TSHRTDP1LTA4HALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116874495-A Pyrido dihydrofuranone derivative and preparation method and application thereof 中山大学 2023-10-13 CN claimed
US-20210138117-A1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2021-05-13 US claimed
EP-3038621-B1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR HUMAN BIOMOLECULAR RES INSTITUTE (US) 2020-12-02 EP claimed
CN-109678759-A Organic blue fluorescent material of a kind of D-A type based on dianthracene and its preparation method and application 陕西师范大学 2019-04-26 CN claimed
EP-3428202-A1 PROCESS OF PRODUCING POLYOLEFINS USING METALLOCENE POLYMERIZATION CATALYSTS AND COPOLYMERS THEREFROM ExxonMobil Chemical Patents Inc. (US) 2019-01-16 EP claimed
CN-105263969-B Using metallocene polymerization catalyst preparation polyolefin and the method for copolymer 埃克森美孚化学专利公司 2017-04-05 CN claimed
US-9611348-B2 Process of producing polyolefins using metallocene polymerization catalysts and copolymers therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-04-04 US claimed
EP-3038621-A2 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR Human Biomolecular Research Institute (US) 2016-07-06 EP claimed
EP-2984111-A1 PROCESS OF PRODUCING POLYOLEFINS USING METALLOCENE POLYMERIZATION CATALYSTS AND COPOLYMERS THEREFROM ExxonMobil Chemical Patents Inc. (US) 2016-02-17 EP claimed
US-20160038641-A1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2016-02-11 US claimed
WO-1995006034-A1 COMPOUNDS AND METHODS FOR INHIBITION OF HIV AND RELATED VIRUSES MEDIVIR AB (SE) 1995-03-02 WO claimed
US-5041651-A Produced by reacting optically active aminoalcohol or salt with borane or metal borohydride SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-08-20 US claimed
US-4923999-A Optically active borane complex and a method for producing an optically active alcohol derivative by the use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-05-08 US claimed
EP-0171175-B1 AN OPTICALLY ACTIVE BORANE COMPLEX AND A METHOD FOR PRODUCING AN OPTICALLY ACTIVE ALCOHOL DERIVATIVE BY THE USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-05-24 EP claimed
US-4760149-A Asymmetrically reducing a ketone with an asymmetrically modified borohydride compound obtained by reacting a borohydride with optically active amino alcohol SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-07-26 US claimed
US-4749809-A Optically active borane complex and a method for producing an optically active alcohol derivative by the use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-06-07 US claimed
US-4716168-A STIMULANTS OF IMMUNE RESPONSE NORWICH EATON PHARMACEUTICALS, INC. (US) 1987-12-29 US claimed
EP-0187705-A2 Imidazo(4,5-f)quinolines useful as immunomodulating agents Norwich Eaton Pharmaceuticals, Inc. (US) 1986-07-16 EP claimed
EP-0171175-A1 An optically active borane complex and a method for producing an optically active alcohol derivative by the use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-02-12 EP claimed
US-4440845-A CHARGE TRANSFER COMPOUND RICOH CO., LTD. (JP) 1984-04-03 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20210138117-A1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR BMP2, BMP4, BMP6 NQO1 2074/4885TSHR 2887/4885TDP1 4775/4885
US-20160038641-A1 COMPOUNDS AND MATRICES FOR USE IN BONE GROWTH AND REPAIR BMP2, BMP4, BMP6 NQO1 2892/4885TSHR 3898/4885TDP1 4712/4885

“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.