SCHEMBL3376895

SCHEMBL3376895

CSc1nc2cc(C(F)(F)F)ccc2c(=O)n1NC(=O)Cc1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.44
RAB9A P51151 2/20 0.42
MAPK14 Q16539 2/20 0.41
GSK3B P49841 1/20 0.41
LMNA P02545 3/20 0.40
USP2 O75604 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 4/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
CSNK1D P48730 3/20 0.39
RORC P51449 2/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL3379765 0.91 NPSR1 (0.54) NPSR1RAB9ALMNAALDH1A1CYP1A2
SCHEMBL3379143 0.90 NPSR1 (0.44) NPSR1RAB9ALMNAL3MBTL1ALDH1A1
SCHEMBL13102007 0.85 HDAC6 (0.43) NPSR1LMNAALDH1A1MEN1HTT
SCHEMBL13282992 0.85 NPSR1 (0.45) NPSR1RAB9AMAPK14LMNAUSP2
SCHEMBL3379725 0.84 NPSR1 (0.57) NPSR1RAB9AMAPK14LMNAUSP2
SCHEMBL3378807 0.84 NPSR1 (0.57) NPSR1RAB9ALMNAUSP2L3MBTL1
SCHEMBL13101623 0.82 SMN1; SMN2 (0.52) RAB9ALMNAALDH1A1MEN1KMT2A
SCHEMBL3379749 0.81 NPSR1 (0.54) NPSR1RAB9ALMNAALDH1A1CYP1A2
SCHEMBL3376843 0.81 NPSR1 (0.53) NPSR1RAB9ALMNAUSP2L3MBTL1
SCHEMBL13102209 0.80 TRPV1 (0.39) NPSR1LMNAUSP2ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1585522-B1 QUINAZOLINONES AS POTASSIUM CHANNEL MODULATORS ICAGEN INC (US) 2010-11-17 EP disclosed
US-20100190746-A1 QUINAZOLINONES AS POTASSIUM CHANNEL MODULATORS ICAGEN, INC. (US) 2010-07-29 US disclosed
EP-1585522-A4 QUINAZOLINONES AS POTASSIUM CHANNEL MODULATORS ICAGEN INC (US) 2006-08-09 EP disclosed
EP-1585522-A2 QUINAZOLINONES AS POTASSIUM CHANNEL MODULATORS Icagen, Inc. (US) 2005-10-19 EP disclosed
US-20040198724-A1 Quinazolinones as potassium channel modulators ICAGEN, INC. 2004-10-07 US disclosed
WO-2004058704-A2 QUINAZOLINONES AS POTASSIUM CHANNEL MODULATORS ICAGEN, INC. (US) 2004-07-15 WO 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-20040198724-A1 Quinazolinones as potassium channel modulators KCNQ1, KCNK17, KCNQ2 NPSR1 1722/4885RAB9A 560/4885MAPK14 1542/4885
US-20100190746-A1 QUINAZOLINONES AS POTASSIUM CHANNEL MODULATORS KCNQ1, KCNK17, KCNQ2 NPSR1 1722/4885RAB9A 560/4885MAPK14 1542/4885

“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.