SCHEMBL7128420

SCHEMBL7128420

CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc2c(c1)CN(C(Cc1ccccc1)(C(=O)[N+](C)(Cc1ccccc1)c1cccc(C#N)c1)c1ccccc1)C2=O

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 12/20 0.34
FEN1 P39748 11/20 0.34
PTGER1 P34995 4/20 0.34
PTGER3 P43115 4/20 0.34
PTGER4 P35408 3/20 0.34
TBXA2R P21731 2/20 0.34
PTGFR P43088 2/20 0.34
PTGIR P43119 2/20 0.34
PTGDR Q13258 2/20 0.34
PTGER2 P43116 3/20 0.33
F10 P00742 1/20 0.31
KCNA5 P22460 1/20 0.31
NR1H2 P55055 1/20 0.31
SDCBP O00560 1/20 0.31
SDC2 P34741 1/20 0.31

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
SCHEMBL7129120 0.80 F10 (0.48) F10
SCHEMBL7130064 0.75 ALOX5AP (0.38) ALOX5APFEN1PTGER1PTGER3PTGER4
SCHEMBL7121933 0.71 HPGD (0.44) ALOX5APFEN1F10
SCHEMBL7129110 0.69 F10 (0.59) ALOX5APFEN1F10
SCHEMBL7125640 0.69 LMNA (0.51) ALOX5APFEN1SDCBPSDC2
SCHEMBL7117836 0.67 ALOX5AP (0.51) ALOX5APFEN1PTGER1PTGER3PTGER4
SCHEMBL7122641 0.67 GAA (0.43) SDCBPSDC2
SCHEMBL7118364 0.64 RAB9A (0.47) ALOX5APFEN1F10
SCHEMBL7126469 0.64 KDM4E (0.56) ALOX5APFEN1
SCHEMBL7128783 0.62 ALOX5AP (0.47) ALOX5APFEN1F10

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-20030114448-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2003-06-19 US disclosed
WO-2002096873-A1 ISOINDOLE AND ISOQUINOLINE DERIVATIVES AS INHIBITORS OF FACTOR XA MILLENNIUM PHARMACEUTICALS, INC. (US) 2002-12-05 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-20030114448-A1 Inhibitors of factor Xa SERPINC1, F11, TFPI ALOX5AP 415/4885FEN1 1574/4885PTGER1 1340/4885

“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.