SCHEMBL469274

SCHEMBL469274

O=C(N/N=C/c1c(O)ccc2ccccc12)c1ccn[nH]1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.68
KMT2A Q03164 9/20 0.68
POLB P06746 3/20 0.68
MAPT P10636 2/20 0.68
KDM4E B2RXH2 1/20 0.68
PSMD14 O00487 1/20 0.68
LMNA P02545 1/20 0.68
ALPI P09923 1/20 0.68
ALPG P10696 1/20 0.68
CASP3 P42574 1/20 0.68
HTT P42858 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
SENP7 Q9BQF6 1/20 0.68
PAX8 Q06710 1/20 0.66
SPHK1 Q9NYA1 1/20 0.64
RRM1 P23921 3/20 0.63
RAB9A P51151 8/20 0.62
KLF5 Q13887 3/20 0.62
NPC1 O15118 7/20 0.62
TDP1 Q9NUW8 1/20 0.59

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
SCHEMBL12767408 0.81 SPHK1 (0.73) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL1639418 0.81 SPHK1 (0.73) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL1639416 0.81 SPHK1 (0.73) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL800974 0.80 PAX8 (1.00) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL1679411 0.80 PAX8 (1.00) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL16713131 0.80 PAX8 (1.00) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL29414666 0.80 PAX8 (1.00) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL2847708 0.79 MEN1 (0.85) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL683715 0.79 MEN1 (0.85) MEN1KMT2APOLBMAPTKDM4E
SCHEMBL21649964 0.79 PAX8 (0.69) MEN1KMT2APOLBMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9895363-B2 Methods for modulating function of proliferating cell nuclear antigen (PCNA) and treating cancer with PCNA-targeting compounds UNIVERSITY OF CINCINNATI (US) 2018-02-20 US disclosed
US-9895363-B2 Methods for modulating function of proliferating cell nuclear antigen (PCNA) and treating cancer with PCNA-targeting compounds UNIVERSITY OF CINCINNATI (US) 2018-02-20 US disclosed
US-20140018385-A1 Identification Of PCNA Targeting Compounds For Cancer Therapy And PCNA Function Regulation UNIVERSITY OF CINCINNATI (US) 2014-01-16 US disclosed
US-20140018385-A1 Identification Of PCNA Targeting Compounds For Cancer Therapy And PCNA Function Regulation UNIVERSITY OF CINCINNATI (US) 2014-01-16 US disclosed
WO-2012033938-A2 IDENTIFICATION OF PCNA TARGETING COMPOUNDS FOR CANCER THERAPY AND PCNA FUNCTION REGULATION UNIVERSITY OF CINCINNATI (US) 2012-03-15 WO 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 (1 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-20140018385-A1 Identification Of PCNA Targeting Compounds For Cancer Therapy And PCNA Function Regulation PCNA, MKI67, PCLAF MEN1 2771/4885KMT2A 2730/4885POLB 94/4885

“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.