SCHEMBL10175640

SCHEMBL10175640

O=C(Cn1c(-c2ccccc2)nc2ccccc21)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.58
HSD17B10 Q99714 1/20 0.58
BCHE P06276 2/20 0.57
PIN1 Q13526 1/20 0.56
MAPT P10636 2/20 0.55
TP53 P04637 1/20 0.55
KMT2A Q03164 1/20 0.54

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
SCHEMBL2607369 0.86 KDM4E (0.71) KDM4EHSD17B10MAPTTP53KMT2A
SCHEMBL2610178 0.86 KDM4E (0.55) KDM4EHSD17B10MAPTKMT2A
SCHEMBL2607470 0.85 KDM4E (0.69) KDM4EHSD17B10MAPTKMT2A
SCHEMBL2607350 0.85 KDM4E (0.62) KDM4EHSD17B10BCHEKMT2A
SCHEMBL2610217 0.85 KDM4E (0.62) KDM4EHSD17B10KMT2A
SCHEMBL2607451 0.83 BCHE (0.52) KDM4EBCHEMAPTTP53KMT2A
SCHEMBL2610183 0.83 MEN1 (0.77) KDM4EHSD17B10MAPTKMT2A
SCHEMBL2607598 0.82 MEN1 (0.69) KDM4EHSD17B10BCHEMAPTKMT2A
SCHEMBL10175827 0.81 KMT2A (0.70) KDM4EMAPTKMT2A
SCHEMBL15643320 0.81 KCNH2 (0.58) KDM4EHSD17B10BCHEPIN1MAPT

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-20120101096-A1 Compounds and Methods for Treating Mammalian Gastrointestinal Microbial Infections University of Georgia Foundation, Inc. (US) 2012-04-26 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 (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-20120101096-A1 Compounds and Methods for Treating Mammalian Gastrointestinal Microbial Infections IMPDH1, IMPDH2, IMPA1 KDM4E 1620/4885HSD17B10 542/4885BCHE 1002/4885

“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.