SCHEMBL15627603

SCHEMBL15627603

CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3cccc(F)c32)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 1.00
PDGFRB P09619 7/20 1.00
EGFR P00533 4/20 1.00
PDGFRA P16234 2/20 1.00
PRKAA1 Q13131 13/20 0.75
PRKAA2 P54646 11/20 0.75
FGFR1 P11362 4/20 0.75
FLT3 P36888 3/20 0.70
KIT P10721 3/20 0.70
PLK4 O00444 2/20 0.70
DCLK1 O15075 2/20 0.70
PDPK1 O15530 2/20 0.70
DAPK3 O43293 2/20 0.70
ROCK2 O75116 2/20 0.70
RPS6KA5 O75582 2/20 0.70
RPS6KA4 O75676 2/20 0.70
MAP4K4 O95819 2/20 0.70
CHEK2 O96017 2/20 0.70
NTRK1 P04629 2/20 0.70
INSR P06213 2/20 0.70

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
SCHEMBL7009123 0.93 KDR (0.86) KDRPDGFRBEGFRPDGFRAPRKAA1
SCHEMBL31726680 0.90 KDR (0.81) KDRPDGFRBEGFRPDGFRAPRKAA1
SCHEMBL7009069 0.88 KDR (0.79) KDRPDGFRBEGFRPDGFRAPRKAA1
SCHEMBL7097360 0.87 KDR (0.77) KDRPDGFRBEGFRPDGFRAPRKAA1
SCHEMBL7096348 0.86 KDR (0.75) KDRPDGFRBEGFRPDGFRAPRKAA1
SCHEMBL16090333 0.86 KDR (0.77) KDRPDGFRBEGFRPDGFRAPRKAA1
SCHEMBL29856874 0.85 KDR (1.00) KDRPDGFRBEGFRPDGFRAPRKAA1
SCHEMBL20226048 0.85 KDR (1.00) KDRPDGFRBEGFRPDGFRAPRKAA1
SCHEMBL2114999 0.85 KDR (1.00) KDRPDGFRBEGFRPDGFRAPRKAA1
SCHEMBL31727530 0.85 KDR (0.74) KDRPDGFRBEGFRPDGFRAPRKAA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2675274-B1 SORAFENIB DERIVATIVES AS sEH INHIBITORS UNIV CALIFORNIA (US) 2017-05-03 EP disclosed
US-9029401-B2 Sorafenib derivatives as sEH inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-05-12 US disclosed
US-20140088156-A1 SORAFENIB DERIVATIVES AS SEH INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-03-27 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-20140088156-A1 SORAFENIB DERIVATIVES AS SEH INHIBITORS EPHX1, FAH, EPHX2 KDR 53/4885PDGFRB 608/4885EGFR 1304/4885

“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.