SCHEMBL6807931

SCHEMBL6807931

Cc1nc(-c2cccc(NC(=O)C(Oc3ccc(-c4ccccc4S(C)(=O)=O)cc3)c3ccccc3)c2)no1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.49
PRSS1 P07477 3/20 0.49
TP53 P04637 5/20 0.47
LMNA P02545 4/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 2/20 0.47
HTT P42858 2/20 0.47
GAA P10253 1/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPT P10636 6/20 0.45
POLB P06746 2/20 0.43
KMT2A Q03164 1/20 0.43
HAVCR2 Q8TDQ0 4/20 0.42
F2 P00734 1/20 0.41
ALDH1A1 P00352 2/20 0.40
TSHR P16473 2/20 0.40
HSD17B10 Q99714 1/20 0.40
USP2 O75604 1/20 0.40
CA2 P00918 1/20 0.40

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
SCHEMBL6298117 0.92 F10 (0.56) F10PRSS1TP53LMNARAB9A
SCHEMBL6808404 0.83 HAVCR2 (0.60) TP53LMNARAB9ANPC1HTT
SCHEMBL6807561 0.82 TP53 (0.63) TP53LMNARAB9ANPC1HTT
SCHEMBL6809066 0.82 TP53 (0.52) F10PRSS1TP53LMNARAB9A
SCHEMBL6807833 0.79 F10 (0.73) F10PRSS1F2
SCHEMBL6806790 0.78 TP53 (0.46) F10PRSS1TP53LMNARAB9A
SCHEMBL5165370 0.74 L3MBTL1 (0.54) TP53LMNARAB9ANPC1HTT
SCHEMBL14408263 0.73 L3MBTL1 (0.50) F10TP53LMNARAB9ANPC1
Acetic Acid SCHEMBL6298091 0.73 F10 (0.83) F10PRSS1F2
SCHEMBL7098774 0.73 PDE4A (0.46) F10PRSS1TP53LMNARAB9A

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 1 patent. 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 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 F10 64/4885PRSS1 1089/4885TP53 1748/4885

“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.