SCHEMBL2929463

SCHEMBL2929463

COCCOc1ccc(F)c(F)c1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.40
KDM4E B2RXH2 4/20 0.40
HPGD P15428 2/20 0.40
KMT2A Q03164 1/20 0.39
GNRHR P30968 1/20 0.39
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 1/20 0.38
ALDH1A1 P00352 1/20 0.37
PTPN1 P18031 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.35
FABP4 P15090 1/20 0.35
GRM2 Q14416 1/20 0.35

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
SCHEMBL18044460 0.84 RARB (0.40) HTTKDM4EHPGDKMT2ALMNA
SCHEMBL18499050 0.84 RARB (0.40) HTTKDM4EHPGDKMT2ALMNA
SCHEMBL18151941 0.84 RARB (0.40) HTTKDM4EHPGDKMT2ALMNA
SCHEMBL2476042 0.84 ALDH1A1 (0.42) HTTKDM4EHPGDKMT2ALMNA
SCHEMBL4992797 0.81 PTPN1 (0.50) KDM4EHPGDKMT2ALMNARAB9A
Hydrogen Peroxide SCHEMBL28069523 0.80 CA12 (0.57) HTTKDM4EKMT2ALMNAMAPK1
SCHEMBL4992986 0.80 CA12 (0.57) HTTKDM4EKMT2ALMNAMAPK1
SCHEMBL28051201 0.78 CA12 (0.60) KDM4EKMT2ALMNAALDH1A1CA12
SCHEMBL18044451 0.77 ALDH1A1 (0.43) KDM4EHPGDKMT2ALMNAALDH1A1
SCHEMBL18499051 0.77 MAPT (0.44) HTTKDM4EHPGDKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1939204-B3 FUSED HETEROCYCLIC DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE THEREOF KISSEI PHARMACEUTICAL (JP) 2022-08-24 EP disclosed
EP-2147922-B1 FUSED HETEROCYCLIC DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE DERIVATIVE, AND USE OF THE COMPOSITION FOR MEDICAL PURPOSES KISSEI PHARMACEUTICAL (JP) 2017-08-02 EP disclosed
US-9040693-B2 Fused heterocyclic derivative, medicinal composition containing the same, and medicinal use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2015-05-26 US disclosed
US-8426427-B2 Fused heterocyclic derivative, pharmaceutical composition comprising the derivative, and use of the composition for medical purposes KISSEI PHARMACEUTICAL CO., LTD. (JP) 2013-04-23 US disclosed
US-8426427-B2 Fused heterocyclic derivative, pharmaceutical composition comprising the derivative, and use of the composition for medical purposes KISSEI PHARMACEUTICAL CO., LTD. (JP) 2013-04-23 US disclosed
US-8426427-B2 Fused heterocyclic derivative, pharmaceutical composition comprising the derivative, and use of the composition for medical purposes KISSEI PHARMACEUTICAL CO., LTD. (JP) 2013-04-23 US disclosed
EP-1939204-B1 FUSED HETEROCYCLIC DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE THEREOF KISSEI PHARMACEUTICAL (JP) 2013-01-02 EP disclosed
US-20100081674-A1 FUSED HETEROCYCLIC DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE DERIVATIVE, AND USE OF THE COMPOSITION FOR MEDICAL PURPOSES KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-04-01 US disclosed
US-20100081674-A1 FUSED HETEROCYCLIC DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE DERIVATIVE, AND USE OF THE COMPOSITION FOR MEDICAL PURPOSES KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-04-01 US disclosed
US-20100081674-A1 FUSED HETEROCYCLIC DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE DERIVATIVE, AND USE OF THE COMPOSITION FOR MEDICAL PURPOSES KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-04-01 US disclosed
EP-2147922-A1 FUSED HETEROCYCLIC DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE DERIVATIVE, AND USE OF THE COMPOSITION FOR MEDICAL PURPOSES Kissei Pharmaceutical Co., Ltd. (JP) 2010-01-27 EP disclosed
US-20090325900-A1 FUSED HETEROCYCLIC DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-12-31 US disclosed
EP-1939204-A1 FUSED HETEROCYCLIC DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2008-07-02 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 (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-20090325900-A1 FUSED HETEROCYCLIC DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE THEREOF SHBG, CYP19A1, NR5A1 HTT 3657/4885KDM4E 930/4885HPGD 728/4885
US-20100081674-A1 FUSED HETEROCYCLIC DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE DERIVATIVE, AND USE OF THE COMPOSITION FOR MEDICAL PURPOSES SHBG, GNRHR, CYP19A1 HTT 1586/4885KDM4E 785/4885HPGD 278/4885

“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.