SCHEMBL17465683

SCHEMBL17465683

NCCNS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccc(F)c(F)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.60
LMNA P02545 12/20 0.59
RECQL P46063 1/20 0.59
POLB P06746 1/20 0.59
TP53 P04637 8/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
NPSR1 Q6W5P4 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.56
HTT P42858 3/20 0.56
KDM4E B2RXH2 2/20 0.55
MAPK1 P28482 1/20 0.55
ALDH1A1 P00352 2/20 0.53
GAA P10253 1/20 0.52
THRB P10828 1/20 0.52

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
Hydrochloric Acid SCHEMBL15847850 0.99 MAPT (0.59) MAPTLMNARECQLPOLBTP53
SCHEMBL15613050 0.89 MAPT (0.61) MAPTLMNARECQLPOLBTP53
SCHEMBL17465684 0.88 LMNA (0.60) MAPTLMNARECQLPOLBTP53
Hydrochloric Acid SCHEMBL15847781 0.87 LMNA (0.59) MAPTLMNARECQLPOLBTP53
SCHEMBL17668340 0.87 LMNA (0.59) MAPTLMNARECQLPOLBTP53
SCHEMBL15847838 0.87 MAPT (0.55) MAPTLMNARECQLPOLBTP53
SCHEMBL15847613 0.86 LMNA (0.58) MAPTLMNARECQLPOLBTP53
SCHEMBL14488016 0.86 LMNA (0.58) MAPTLMNARECQLPOLBTP53
SCHEMBL15612869 0.86 MAPT (0.54) MAPTLMNARECQLPOLBTP53
SCHEMBL14485055 0.85 MAPT (0.80) MAPTLMNARECQLPOLBTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938236-B2 Antiviral agents against HBV infection DREXEL UNIVERSITY (US) 2018-04-10 US disclosed
US-9938236-B2 Antiviral agents against HBV infection DREXEL UNIVERSITY (US) 2018-04-10 US disclosed
US-20160024004-A1 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-01-28 US disclosed
US-20160024004-A1 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-01-28 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-20160024004-A1 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION HAVCR2, EIF2AK2, NR1H4 MAPT 4494/4885LMNA 1478/4885RECQL 336/4885

“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.