SCHEMBL3540389

SCHEMBL3540389

CCc1nccc(NC(=O)CCCc2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)c1Cl

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLAAT3 P53816 1/20 0.52
PLAAT5 Q96KN8 1/20 0.52
PLAAT2 Q9NWW9 1/20 0.52
PLAAT4 Q9UL19 1/20 0.52
LMNA P02545 1/20 0.46
LIPE Q05469 10/20 0.43
GFER P55789 1/20 0.42
SCN9A Q15858 2/20 0.41
DAGLA Q9Y4D2 1/20 0.41
RAB9A P51151 1/20 0.39

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
SCHEMBL3549808 0.95 PLAAT3 (0.47) PLAAT3PLAAT5PLAAT2PLAAT4LMNA
SCHEMBL8410599 0.90 LMNA (0.48) PLAAT3PLAAT5PLAAT2PLAAT4LMNA
SCHEMBL8330868 0.80 EPHX2 (0.46) LMNA
SCHEMBL15684814 0.76 LMNA (0.48) PLAAT3PLAAT5PLAAT2PLAAT4LMNA
SCHEMBL5261641 0.75 SCN9A (0.42) PLAAT3PLAAT5PLAAT2PLAAT4LMNA
SCHEMBL15684950 0.74 PLAAT3 (0.47) PLAAT3PLAAT5PLAAT2PLAAT4LMNA
SCHEMBL8410794 0.74 LMNA (0.47) PLAAT3PLAAT5PLAAT2PLAAT4LMNA
SCHEMBL8412024 0.73 L3MBTL1 (0.47) LMNARAB9A
SCHEMBL15684905 0.72 LMNA (0.47) PLAAT3PLAAT5PLAAT2PLAAT4LMNA
SCHEMBL15684930 0.72 LMNA (0.45) PLAAT3PLAAT5PLAAT2PLAAT4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7652041-B2 4-[4-(3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}propyl)phenoxy]pyridino-2-carboxamido: N-methyl-4-[4-(3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}propyl)phenoxy]pyridine-2-carboxamide: Raf-kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-01-26 US claimed
EP-1856053-A1 CINNAMIDE AND HYDROCINNAMIDE DERIVATIVES WITH RAF-KINASE INHIBITORY ACTIVITY MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-11-21 EP claimed
WO-2006076706-A1 CINNAMIDE AND HYDROCINNAMIDE DERIVATIVES WITH RAF-KINASE INHIBITORY ACTIVITY MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-07-20 WO claimed
US-20060160803-A1 Cinnamide and hydrocinnamide derivatives with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-07-20 US claimed
US-7652041-B2 4-[4-(3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}propyl)phenoxy]pyridino-2-carboxamido: N-methyl-4-[4-(3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}propyl)phenoxy]pyridine-2-carboxamide: Raf-kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-01-26 US disclosed
US-20060160803-A1 Cinnamide and hydrocinnamide derivatives with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-07-20 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-20060160803-A1 Cinnamide and hydrocinnamide derivatives with kinase inhibitory activity MAP3K21, HIPK4, MAP3K20 PLAAT3 1325/4885PLAAT5 1888/4885PLAAT2 2313/4885

“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.