SCHEMBL6460751

SCHEMBL6460751

Cn1nc(-c2ccccn2)nc1-c1cc(Cl)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.46
KDM4E B2RXH2 1/20 0.46
APAF1 O14727 1/20 0.46
NPC1 O15118 1/20 0.46
KDM4A O75164 1/20 0.46
TDP2 O95551 1/20 0.46
EGFR P00533 1/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46
PPARG P37231 1/20 0.46
CASP3 P42574 1/20 0.46
HTT P42858 1/20 0.46
RECQL P46063 1/20 0.46
RAB9A P51151 1/20 0.46
DUSP3 P51452 1/20 0.46
GALK1 P51570 1/20 0.46
BLM P54132 1/20 0.46
CASP7 P55210 1/20 0.46

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
SCHEMBL6457282 0.88 NPC1 (0.48) MAPK1KDM4EAPAF1NPC1KDM4A
SCHEMBL6453666 0.85 KDM4E (0.46) MAPK1KDM4EAPAF1NPC1KDM4A
SCHEMBL6459175 0.84 KDM4A (0.52) MAPK1KDM4EAPAF1NPC1KDM4A
SCHEMBL6449102 0.84 MAPT (0.46) MAPK1KDM4EAPAF1NPC1KDM4A
SCHEMBL6450015 0.83 CYP19A1 (0.49) MAPK1KDM4EAPAF1NPC1KDM4A
SCHEMBL6451150 0.82 NPC1 (0.44) MAPK1KDM4EAPAF1NPC1KDM4A
SCHEMBL6454166 0.82 CYP19A1 (0.42) HTTCYP19A1NR1H2NR1H3SPR
SCHEMBL6450036 0.81 F12 (0.48) MAPK1KDM4EAPAF1NPC1KDM4A
SCHEMBL6453933 0.77 IDH1 (0.51) MAPK1KDM4EAPAF1NPC1KDM4A
SCHEMBL30090507 0.77 CYP19A1 (0.56) MAPK1NPC1LMNAPOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus ANADYS PHARMACEUTICALS, INC. (US) 2005-04-07 US disclosed
WO-2004110351-A2 HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS ANADYS PHARMACEUTICALS, INC. (US) 2004-12-23 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-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus HAVCR2, HCCS, LIPC MAPK1 4158/4885KDM4E 3106/4885APAF1 2700/4885

“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.