SCHEMBL9764115

SCHEMBL9764115

Oc1c(C23CC4CC(CC(C4)C2)C3)ccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN22 Q9Y2R2 1/20 0.44
LDHA P00338 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
RARB P10826 2/20 0.38
RARG P13631 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
RARA P10276 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL13004790 0.81 PTPN22 (0.46) PTPN22LDHAALDH1A1MAPTKDM4E
SCHEMBL548996 0.80 MEN1 (0.48) MEN1KMT2AALDH1A1MAPTRARB
SCHEMBL3043614 0.79 SLC6A3 (0.41) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL27714503 0.79 MEN1 (0.40) MEN1KMT2AALDH1A1MAPTRARB
SCHEMBL8359113 0.78 PTPN22 (0.37) PTPN22LDHAALDH1A1MAPTKDM4E
Phosphine SCHEMBL28240146 0.77 SLC6A3 (0.41) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL548737 0.76 MEN1 (0.46) MEN1KMT2AALDH1A1MAPTRARB
SCHEMBL13004762 0.76 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTRARB
SCHEMBL13004815 0.75 NQO2 (0.46) MEN1KMT2AALDH1A1MAPTRARB
SCHEMBL3768061 0.73 MEN1 (0.52) MEN1KMT2AALDH1A1MAPTRARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10175589-B2 Quinone derivative and electrophotographic photosensitive member KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2019-01-08 US disclosed
US-20170363978-A1 QUINONE DERIVATIVE AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2017-12-21 US disclosed
US-20170363978-A1 QUINONE DERIVATIVE AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER KYOCERA DOCUMENT SOLUTIONS INC. (JP) 2017-12-21 US disclosed
US-20100316950-A1 COMPOSITION FOR FORMING BASE FILM FOR LITHOGRAPHY AND METHOD FOR FORMING MULTILAYER RESIST PATTERN MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-12-16 US disclosed
US-20100316950-A1 COMPOSITION FOR FORMING BASE FILM FOR LITHOGRAPHY AND METHOD FOR FORMING MULTILAYER RESIST PATTERN MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-12-16 US disclosed
US-5015758-A Process for the preparation of 1-adamantane derivatives CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (CIRD) (FR) 1991-05-14 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-10175589-B2 Quinone derivative and electrophotographic photosensitive member KEAP1, NQO1, CBR3 PTPN22 2368/4885LDHA 3052/4885MEN1 1482/4885
US-20170363978-A1 QUINONE DERIVATIVE AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER KEAP1, NQO1, CBR3 PTPN22 2368/4885LDHA 3052/4885MEN1 1482/4885

“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.