SCHEMBL17124151

SCHEMBL17124151

O=[N+]([O-])c1cccc(Nc2ncnc3ccc(Br)cc23)c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.84
ABCG2 Q9UNQ0 2/20 0.76
MAPK1 P28482 2/20 0.64
MEN1 O00255 2/20 0.64
MAPT P10636 2/20 0.64
HTT P42858 2/20 0.64
KMT2A Q03164 2/20 0.64
KDM4E B2RXH2 2/20 0.64
NPC1 O15118 1/20 0.64
PRNP P04156 1/20 0.64
CYP1A2 P05177 1/20 0.64
CYP3A4 P08684 1/20 0.64
CYP2D6 P10635 1/20 0.64
CYP2C9 P11712 1/20 0.64
CYP2C19 P33261 1/20 0.64
ALDH1A1 P00352 1/20 0.64
TNF P01375 1/20 0.64
POLB P06746 1/20 0.64
CRHBP P24387 1/20 0.64
CRHR2 Q13324 1/20 0.64

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
SCHEMBL3244621 0.92 EGFR (1.00) EGFRABCG2ERBB2
SCHEMBL30552991 0.92 EGFR (1.00) EGFRABCG2ERBB2
SCHEMBL4354577 0.86 ABCG2 (1.00) EGFRABCG2MEN1KMT2AKDM4E
SCHEMBL4587672 0.84 ALK (0.79) EGFRABCG2MAPK1MEN1MAPT
SCHEMBL18349251 0.83 EGFR (0.77) EGFRABCG2MEN1MAPTHTT
SCHEMBL1192454 0.82 EGFR (1.00) EGFRABCG2MAPK1MEN1MAPT
SCHEMBL8871504 0.82 EGFR (0.76) EGFRABCG2MAPK1MAPTHTT
SCHEMBL8871973 0.82 EGFR (0.83) EGFRABCG2MEN1MAPTHTT
SCHEMBL4587413 0.82 EGFR (0.83) EGFRABCG2MEN1MAPTHTT
SCHEMBL2099212 0.80 ABCG2 (1.00) EGFRABCG2MAPK1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9387213-B2 Small molecules inhibiting oncoprotein Myc HEALTH RESEARCH, INC. (US) 2016-07-12 US disclosed
US-20150272960-A1 SMALL MOLECULES INHIBITING ONCOPROTEIN MYC HEALTH RESEARCH, INC. 2015-10-01 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 (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-20150272960-A1 SMALL MOLECULES INHIBITING ONCOPROTEIN MYC MYC, MYCBP, MYCBP2 EGFR 555/4885ABCG2 1549/4885MAPK1 1432/4885

“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.