SCHEMBL10179209

SCHEMBL10179209

N=C(N)c1cccc(Oc2ccc(C(F)(F)F)cc2NC(=O)c2ccc(-c3ccccc3S)cc2)c1

nearest known ligand 0.79

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.79
PLG P00747 1/20 0.60
PLAT P00750 1/20 0.60
KLK1 P06870 1/20 0.60
PRSS1 P07477 1/20 0.60
MAPT P10636 3/20 0.53
KDM4E B2RXH2 2/20 0.53
LMNA P02545 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MAPK1 P28482 1/20 0.48
F2 P00734 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
ATM Q13315 1/20 0.46
NPSR1 Q6W5P4 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
SCHEMBL10181480 0.90 F10 (0.77) F10PLGPLATKLK1PRSS1
SCHEMBL13348900 0.90 F10 (0.64) F10PLGPLATKLK1PRSS1
SCHEMBL10178330 0.89 F10 (0.75) F10PLGPLATKLK1PRSS1
SCHEMBL14310049 0.88 F10 (0.66) F10PLGPLATKLK1PRSS1
SCHEMBL890901 0.88 F10 (1.00) F10PLGPLATKLK1PRSS1
SCHEMBL10178095 0.87 F10 (0.61) F10PLGPLATKLK1PRSS1
SCHEMBL10179032 0.83 F10 (0.77) F10PLGPLATKLK1PRSS1
SCHEMBL10178363 0.78 F10 (0.53) F10PLGPLATKLK1PRSS1
SCHEMBL890654 0.77 F10 (1.00) F10PLGPLATKLK1PRSS1
SCHEMBL7439982 0.77 F10 (0.86) F10PLGPLATKLK1PRSS1

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-20120083602-A1 BENZAMIDES AND RELATED INHIBITORS OF FACTOR XA MILLENNIUM PHARMACEUTICALS, INC. 2012-04-05 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-20120083602-A1 BENZAMIDES AND RELATED INHIBITORS OF FACTOR XA TFPI, F12, TFPI2 F10 13/4885PLG 18/4885PLAT 25/4885

“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.