SCHEMBL6804740

SCHEMBL6804740

Cc1nc(-c2cccc(NC(=O)COc3cccc(NC(N)=O)c3)c2)no1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HAVCR2 Q8TDQ0 15/20 0.64
TP53 P04637 3/20 0.54
NPC1 O15118 1/20 0.54
LMNA P02545 1/20 0.54
GAA P10253 1/20 0.54
MAPK1 P28482 1/20 0.54
HTT P42858 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
MAPT P10636 3/20 0.52
POLB P06746 1/20 0.50

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
SCHEMBL6809084 0.91 SMN1; SMN2 (0.66) HAVCR2TP53NPC1LMNAGAA
SCHEMBL13273862 0.86 MAPT (0.63) HAVCR2TP53NPC1LMNAGAA
SCHEMBL6809066 0.80 TP53 (0.52) HAVCR2TP53NPC1LMNAGAA
SCHEMBL6808404 0.78 HAVCR2 (0.60) HAVCR2TP53NPC1LMNAGAA
SCHEMBL6806801 0.76 MAPT (0.62) TP53NPC1LMNAMAPK1RAB9A
SCHEMBL6989364 0.75 TP53 (0.51) HAVCR2TP53NPC1LMNAGAA
SCHEMBL6989368 0.74 TP53 (0.46) HAVCR2TP53NPC1LMNAGAA
SCHEMBL6809002 0.74 F10 (0.60) NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL6808723 0.72 SMN1; SMN2 (0.60) TP53NPC1MAPK1HTTRAB9A
SCHEMBL8268112 0.72 MAPT (0.60) HAVCR2TP53NPC1LMNAGAA

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-20040092517-A1 Phenyl derivatives and their use in the treatment of thromboembolic disorders or tumours MERCK PATENT GMBH (DE) 2004-05-13 US claimed
US-20040092517-A1 Phenyl derivatives and their use in the treatment of thromboembolic disorders or tumours MERCK PATENT GMBH (DE) 2004-05-13 US 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-20040092517-A1 Phenyl derivatives and their use in the treatment of thromboembolic disorders or tumours RCOR3, F2, NCOR2 HAVCR2 226/4885TP53 1748/4885NPC1 2490/4885

“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.