SCHEMBL13192047

SCHEMBL13192047

Nc1ccc2ncnc(NCc3ccc(F)cc3)c2c1

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP10 Q14694 1/20 0.80
PIK3C3 Q8NEB9 1/20 0.80
USP13 Q92995 1/20 0.80
EGFR P00533 11/20 0.76
CNR1 P21554 1/20 0.62
CNR2 P34972 1/20 0.62
ERBB2 P04626 2/20 0.60
LMNA P02545 2/20 0.57
HTT P42858 3/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HDAC1 Q13547 1/20 0.51
GALR3 O60755 1/20 0.50
NR2F2 P24468 1/20 0.50
RAB9A P51151 1/20 0.50
TP53 P04637 1/20 0.50

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
SCHEMBL29359604 0.89 USP10 (1.00) USP10PIK3C3USP13EGFRCNR1
SCHEMBL1068401 0.89 USP10 (1.00) USP10PIK3C3USP13EGFRCNR1
SCHEMBL9921506 0.84 USP10 (0.80) USP10PIK3C3USP13EGFRCNR1
SCHEMBL7469214 0.82 USP10 (0.76) USP10PIK3C3USP13EGFRCNR1
SCHEMBL13170963 0.81 USP10 (0.84) USP10PIK3C3USP13EGFRCNR1
SCHEMBL9921341 0.81 USP10 (0.84) USP10PIK3C3USP13EGFRCNR1
SCHEMBL13192093 0.81 EGFR (0.67) USP10PIK3C3USP13EGFRCNR1
SCHEMBL27923391 0.80 EGFR (0.73) EGFRERBB2LMNA
SCHEMBL9921511 0.79 USP10 (0.70) USP10PIK3C3USP13EGFRCNR1
SCHEMBL13191863 0.78 PDE5A (0.76) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120258975-A1 Potent Small Molecule Inhibitors of Autophagy, and Methods of Use Thereof SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY (CN) 2012-10-11 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-20120258975-A1 Potent Small Molecule Inhibitors of Autophagy, and Methods of Use Thereof ATG7, BECN1, SQSTM1 USP10 1695/4885PIK3C3 186/4885USP13 2044/4885

“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.