SCHEMBL1390874

SCHEMBL1390874

Cc1ccc(CNc2nc(Cl)nc(Nc3cccc(Cl)c3)n2)o1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.49
KMT2A Q03164 4/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPK1 P28482 5/20 0.46
MAPT P10636 5/20 0.46
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KDM4E B2RXH2 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SOS1 Q07889 1/20 0.46
POLB P06746 2/20 0.45
EGFR P00533 1/20 0.45
RECQL P46063 2/20 0.45
HTT P42858 1/20 0.44
GBA1 P04062 1/20 0.43
APP P05067 1/20 0.43
BLM P54132 1/20 0.42
NR1I2 O75469 1/20 0.42
AHR P35869 1/20 0.42
MEN1 O00255 2/20 0.42

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
SCHEMBL1391407 0.87 TRPC5 (0.48) NFKB1KMT2AMAPK1MAPTLMNA
SCHEMBL10282666 0.85 APP (0.64) NFKB1MAPK1MAPTLMNAAPP
SCHEMBL1390950 0.83 LMNA (0.50) KMT2AMAPK1MAPTLMNASMN1; SMN2
SCHEMBL1391280 0.83 GBA1 (0.45) NFKB1KMT2AALDH1A1MAPK1MAPT
SCHEMBL5015104 0.81 KCNH3 (0.60) RECQL
SCHEMBL1391144 0.81 KMT2A (0.65) KMT2AALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL1391601 0.80 NPC1 (0.48) KMT2AMAPK1MAPTLMNASMN1; SMN2
SCHEMBL1391463 0.80 APP (0.46) KMT2AALDH1A1MAPK1MAPTLMNA
SCHEMBL1391966 0.78 MAPT (0.50) KMT2AMAPK1MAPTLMNAKDM4E
SCHEMBL8526184 0.76 NFKB1 (0.69) NFKB1KMT2AALDH1A1MAPK1MAPT

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-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof PROGENICS PHARMACEUTICALS, INC. (US) 2012-01-12 US disclosed
US-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof PROGENICS PHARMACEUTICALS, INC. (US) 2012-01-12 US disclosed
EP-2231624-A2 TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF Progenics Pharmaceuticals, Inc. (US) 2010-09-29 EP disclosed
WO-2009091388-A2 TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF PROGENICS PHARMACEUTICALS, INC. (US) 2009-07-23 WO disclosed
WO-2009091388-A2 TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF PROGENICS PHARMACEUTICALS, INC. (US) 2009-07-23 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-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof HAVCR2, ZC3HAV1, MAVS NFKB1 727/4885KMT2A 4066/4885ALDH1A1 2382/4885

“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.