SCHEMBL438892

SCHEMBL438892

C=Cc1cccc2c1OCO2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.49
ABCG2 Q9UNQ0 1/20 0.46
MAOB P27338 4/20 0.42
KDM4E B2RXH2 1/20 0.39
EED O75530 1/20 0.36
PKM P14618 1/20 0.36
TSHR P16473 1/20 0.36
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
TTBK1 Q5TCY1 1/20 0.35
TTBK2 Q6IQ55 1/20 0.35
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.33
TXNRD1 Q16881 1/20 0.33
TXNRD3 Q86VQ6 1/20 0.33
TXNRD2 Q9NNW7 1/20 0.33

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
SCHEMBL161792 0.81 GSK3B (0.54) GSK3BABCG2MAOBKDM4EEED
SCHEMBL29706697 0.81 GSK3B (0.54) GSK3BABCG2MAOBKDM4EEED
SCHEMBL16398867 0.79 GSK3B (0.49) GSK3BABCG2MAOBKDM4EEED
SCHEMBL4803778 0.79 GSK3B (0.49) GSK3BABCG2MAOBKDM4EEED
SCHEMBL13972664 0.76 MAOB (0.50) GSK3BABCG2MAOBKDM4EEED
SCHEMBL6061016 0.76
SCHEMBL7228549 0.75 GSK3B (0.45) GSK3BABCG2MAOBKDM4EEED
SCHEMBL9670572 0.75 GSK3B (0.45) GSK3BABCG2MAOBKDM4EEED
SCHEMBL9645979 0.75 GSK3B (0.45) GSK3BABCG2MAOBKDM4EEED
SCHEMBL18936053 0.75 KDM4E (0.33) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025047654-A1 POSITIVE PHOTOSENSITIVE PIGMENT COMPOSITION, CURED FILM CONTAINING CURED PRODUCT THEREOF, ORGANIC EL DISPLAY DEVICE, ELECTRONIC APPARATUS, AND BLOCK COPOLYMER 東レ株式会社 2025-03-06 WO disclosed
EP-3209639-B1 COMPOUNDS AS ANTI-MALARIALS AND THEIR PROCESS OF PREPARATION COUNCIL SCIENT IND RES (IN) 2020-09-16 EP disclosed
US-20190106380-A1 Aromatic Derivatives As Anti-Malarial COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2019-04-11 US disclosed
CN-109381462-A A kind of hypoglycemic purposes of piperlongumine Alkaloid 中国科学院新疆理化技术研究所 2019-02-26 CN disclosed
CN-109350614-A A kind of hypoglycemic purposes of piperlongumine alkaloid 中国科学院新疆理化技术研究所 2019-02-19 CN disclosed
EP-1551885-B1 PROCESS TO MODIFY POLYMERIC MATERIALS 3M INNOVATIVE PROPERTIES CO (US) 2016-02-17 EP disclosed
US-8101711-B2 Process to modify polymeric materials and resulting compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-01-24 US disclosed
US-20100048819-A1 PROCESS TO MODIFY POLYMERIC MATERIALS AND RESULTING COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2010-02-25 US disclosed
US-7632916-B2 Thermally induced graft polymerization in an apparatus by shearing, devolatilization; grafting isoprene-t-butyl methacrylate copolymer with polyoxyethylene glycol methyl ether, forming methacrylic acid/anhydride monomers 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-12-15 US disclosed
US-20070122915-A1 Continuous process for the production of combinatorial libraries of modified materials 3M INNOVATIVE PROPETIES COMPANY 2007-05-31 US disclosed
US-20070078120-A1 Novel piperidine derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-05 US disclosed
US-7157283-B2 Continuous process for the production of combinatorial libraries of modified materials 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-01-02 US disclosed
EP-1551885-A2 PROCESS TO MODIFY POLYMERIC MATERIALS AND RESULTING COMPOSITIONS 3M Innovative Properties Company (US) 2005-07-13 EP disclosed
EP-1551547-A1 A CONTINUOUS PROCESS FOR THE PRODUCTION OF COMBINATORIAL LIBRARIES OF MODIFIED MATERIALS 3M Innovative Properties Company (US) 2005-07-13 EP disclosed
WO-2004012858-A1 A CONTINUOUS PROCESS FOR THE PRODUCTION OF COMBINATORIAL LIBRARIES OF MODIFIED MATERIALS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-02-12 WO disclosed
WO-2004013189-A2 PROCESS TO MODIFY POLYMERIC MATERIALS AND RESULTING COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-02-12 WO disclosed
US-20040023398-A1 Continuous process for the production of combinatorial libraries of modified materials 3M INNOVATIVE PROPERTIES COMPANY 2004-02-05 US disclosed
US-20040024130-A1 Process to modify polymeric materials and resulting compositions 3M INNOVATIVE PROPERTIES COMPANY 2004-02-05 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 (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-20190106380-A1 Aromatic Derivatives As Anti-Malarial TYR, CYP3A43, H1-3 GSK3B 2488/4885ABCG2 4/4885MAOB 198/4885
US-20070078120-A1 Novel piperidine derivative LDLR, PRMT5, MSR1 GSK3B 4076/4885ABCG2 829/4885MAOB 4021/4885

“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.