SCHEMBL14940545

SCHEMBL14940545

Cc1cc(C)c(Nc2nc(Cl)nc(Nc3c(C)cc(C)cc3C)n2)c(C)c1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 12/20 0.54
NFKB1 P19838 1/20 0.47
CRHR1 P34998 4/20 0.46
APP P05067 1/20 0.44
NPC1 O15118 1/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL14940191 0.96 RAPGEF4 (0.54) RAPGEF4NFKB1CRHR1
SCHEMBL1181478 0.82 RAPGEF4 (0.52) RAPGEF4CRHR1
SCHEMBL1181728 0.81 CYP2C9 (0.48) RAPGEF4NFKB1APPNPC1POLB
SCHEMBL14940258 0.81 NFKB1 (0.45) RAPGEF4NFKB1CRHR1APPNPC1
SCHEMBL14940406 0.80 RAPGEF4 (0.54) RAPGEF4CRHR1NPC1
SCHEMBL5447308 0.79 RAPGEF4 (0.48) RAPGEF4CRHR1
SCHEMBL14347189 0.79 RAPGEF4 (0.58) RAPGEF4CRHR1NPC1
SCHEMBL16206659 0.78 CRHR1 (0.54) RAPGEF4CRHR1
SCHEMBL1181589 0.77 NFKB1 (0.53) NFKB1APPNPC1POLB
SCHEMBL14939965 0.76 NFKB1 (0.56) NFKB1APPNPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140323488-A1 DISUBSTITUTED TRIAZINE DIMERS FOR TREATMENT AND/OR PREVENTION OF INFECTIOUS DISEASES UNIVERSITEIT ANTWERPEN (BE) 2014-10-30 US disclosed
US-20140323488-A1 DISUBSTITUTED TRIAZINE DIMERS FOR TREATMENT AND/OR PREVENTION OF INFECTIOUS DISEASES UNIVERSITEIT ANTWERPEN (BE) 2014-10-30 US disclosed
US-20140323488-A1 DISUBSTITUTED TRIAZINE DIMERS FOR TREATMENT AND/OR PREVENTION OF INFECTIOUS DISEASES UNIVERSITEIT ANTWERPEN (BE) 2014-10-30 US disclosed
EP-2776410-A1 DISUBSTITUTED TRIAZINE DIMERS FOR TREATMENT AND/OR PREVENTION OF INFECTIOUS DISEASES Universiteit Antwerpen (BE) 2014-09-17 EP disclosed
WO-2013068551-A1 DISUBSTITUTED TRIAZINE DIMERS FOR TREATMENT AND/OR PREVENTION OF INFECTIOUS DISEASES UNIVERSITEIT ANTWERPEN (BE) 2013-05-16 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 (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-20140323488-A1 DISUBSTITUTED TRIAZINE DIMERS FOR TREATMENT AND/OR PREVENTION OF INFECTIOUS DISEASES TBC1D15, TBC1D5, DHFR RAPGEF4 4150/4885NFKB1 559/4885CRHR1 4237/4885

“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.