SCHEMBL15840753

SCHEMBL15840753

CCCc1c(C)nc(Nc2nc(C)c3cc(C)cc(C)c3n2)[nH]c1=O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.71
TP53 P04637 1/20 0.61
STAT1 P42224 1/20 0.61
MAPT P10636 10/20 0.52
USP2 O75604 2/20 0.52
TSHR P16473 1/20 0.52
POLB P06746 1/20 0.49
ALDH1A1 P00352 6/20 0.48
RAB9A P51151 2/20 0.48
LMNA P02545 2/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
HSD17B10 Q99714 3/20 0.47
HTT P42858 3/20 0.46
NPSR1 Q6W5P4 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
XBP1 P17861 1/20 0.46
KDM4E B2RXH2 2/20 0.42
PARP1 P09874 1/20 0.41
ALOX15 P16050 1/20 0.40

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
SCHEMBL15840587 0.84 MAPT (0.52) STAT3TP53STAT1MAPTUSP2
SCHEMBL15840834 0.82 MAPT (0.68) STAT3MAPTUSP2TSHRPOLB
SCHEMBL15840770 0.82 MAPT (0.62) STAT3MAPTUSP2TSHRPOLB
SCHEMBL15840657 0.78 STAT3 (0.72) STAT3TP53STAT1MAPTPOLB
SCHEMBL15840586 0.77 MAPT (0.73) STAT3MAPTUSP2TSHRPOLB
SCHEMBL15840784 0.77 MAPT (0.56) STAT3MAPTUSP2TSHRPOLB
SCHEMBL15840602 0.76 STAT3 (0.69) STAT3TP53STAT1MAPTPOLB
SCHEMBL15840676 0.76 STAT3 (1.00) STAT3TP53STAT1MAPTPOLB
SCHEMBL15840614 0.75 MAPT (0.64) STAT3MAPTUSP2TSHRPOLB
SCHEMBL15840677 0.74 MAPT (0.69) STAT3MAPTUSP2TSHRPOLB

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-20210220408-A1 ARYL HYDROCARBON RECEPTOR ANTAGONISTS AND METHODS OF USE EDIGENE BIOTECHNOLOGY, INC. (CN) 2021-07-22 US disclosed
US-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT Errico, Joseph P. (US) 2014-06-26 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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT EGFR, ERBB2, ERBB3 STAT3 429/4885TP53 230/4885STAT1 3431/4885
US-20210220408-A1 ARYL HYDROCARBON RECEPTOR ANTAGONISTS AND METHODS OF USE AHR, ARNT, ARSA STAT3 787/4885TP53 1313/4885STAT1 677/4885

“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.