SCHEMBL14940245

SCHEMBL14940245

Cc1cc(C)c(Oc2nc(Cl)nc(Nc3ccccc3)n2)c(C)c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NFKB1 P19838 2/20 0.54
▸ MAPT P10636 2/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ LMNA P02545 1/20 0.51
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ RORC P51449 4/20 0.45
▸ HSP90AA1 P07900 1/20 0.45
▸ APP P05067 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ CA12 O43570 2/20 0.42
▸ CA1 P00915 2/20 0.42
▸ CA2 P00918 2/20 0.42
▸ CA9 Q16790 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL14940422 0.84 NPC1 (0.45) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL14940095 0.84 CYP2C9 (0.53) NFKB1MAPTNPC1RORCHSP90AA1
SCHEMBL14940279 0.84 SLC2A1 (0.48) NFKB1KMT2AHSP90AA1APPPOLB
SCHEMBL14940670 0.83 KCNH3 (0.53) RAB9A
SCHEMBL4307871 0.78 HSP90AA1 (0.53) NFKB1MAPTMEN1KMT2AHSP90AA1
SCHEMBL49211 0.78 HSP90AA1 (0.53) MAPTMEN1KMT2AHSP90AA1SMN1; SMN2
SCHEMBL14369688 0.78 CYP2C9 (0.59) NFKB1MAPTNPC1RORCHSP90AA1
SCHEMBL8330270 0.77 MAPT (0.68) NFKB1MAPTMEN1MAPK1KMT2A
SCHEMBL14940663 0.77 CYP2C9 (0.53) NFKB1MAPTMAPK1LMNANPC1
SCHEMBL16206671 0.77 CYP2C9 (0.46) MAPTMEN1KMT2ALMNANPC1

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-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 NFKB1 559/4885MAPT 657/4885MEN1 2962/4885

“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.

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