SCHEMBL3414928

SCHEMBL3414928

CSc1nc2c(C)csc2c(=O)n1NC(=O)Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.45
RAB9A P51151 3/20 0.43
ALDH1A1 P00352 6/20 0.42
HTT P42858 3/20 0.42
LMNA P02545 3/20 0.42
TSHR P16473 1/20 0.42
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2C19 P33261 2/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
THRB P10828 1/20 0.40
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
CDK5 Q00535 1/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL13283000 0.85 NPSR1 (0.44) NPSR1RAB9AALDH1A1HTTLMNA
SCHEMBL13282917 0.79 RAB9A (0.43) NPSR1RAB9AALDH1A1HTTLMNA
SCHEMBL3378677 0.78 PRKACA (0.40) NPSR1RAB9ALMNAMEN1KMT2A
SCHEMBL13282919 0.72 NPSR1 (0.55) NPSR1RAB9AALDH1A1HTTLMNA
SCHEMBL3379725 0.71 NPSR1 (0.57) NPSR1RAB9AALDH1A1HTTLMNA
SCHEMBL13102113 0.70 ALDH1A1 (0.49) NPSR1RAB9AALDH1A1HTTLMNA
SCHEMBL13102104 0.69 ALDH1A1 (0.49) NPSR1RAB9AALDH1A1HTTLMNA
SCHEMBL3378370 0.69 NPSR1 (0.55) NPSR1RAB9AALDH1A1HTTLMNA
SCHEMBL13102244 0.69 RORC (0.38) NPSR1ALDH1A1HTTLMNAMEN1
SCHEMBL11051146 0.69 SMN1; SMN2 (0.45) NPSR1RAB9AALDH1A1LMNAKMT2A

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 560/4885ALDH1A1 2776/4885
US-20100190746-A1 QUINAZOLINONES AS POTASSIUM CHANNEL MODULATORS KCNQ1, KCNK17, KCNQ2 NPSR1 1722/4885RAB9A 560/4885ALDH1A1 2776/4885

“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.