SCHEMBL3540130

SCHEMBL3540130

CCCC/C(=C/c1cccc(OC)c1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.58
PTGES O14684 3/20 0.58
PPARG P37231 2/20 0.58
MEN1 O00255 1/20 0.56
ALDH1A1 P00352 1/20 0.56
KMT2A Q03164 1/20 0.56
APEX1 P27695 3/20 0.50
MAPT P10636 1/20 0.49
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
FOS P01100 1/20 0.46
JUN P05412 1/20 0.46
BCHE P06276 1/20 0.46
EPHX2 P34913 2/20 0.44

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
SCHEMBL5319431 0.95 MEN1 (0.53) ALOX5PTGESPPARGMEN1ALDH1A1
SCHEMBL20184152 0.86 ALDH1A1 (0.58) MEN1ALDH1A1KMT2AMAPTFOS
SCHEMBL7814561 0.86 ALDH1A1 (0.58) MEN1ALDH1A1KMT2AMAPTFOS
SCHEMBL7814564 0.86 ALDH1A1 (0.58) MEN1ALDH1A1KMT2AMAPTFOS
SCHEMBL3544382 0.86 ALDH1A1 (0.61) MEN1ALDH1A1KMT2AMAPTFOS
SCHEMBL3544381 0.86 ALDH1A1 (0.61) MEN1ALDH1A1KMT2AMAPTFOS
SCHEMBL3549405 0.86 ALDH1A1 (0.61) MEN1ALDH1A1KMT2AMAPTFOS
SCHEMBL3145879 0.85 EPHX2 (0.49) ALOX5PTGESPPARGMEN1ALDH1A1
SCHEMBL3145890 0.85 EPHX2 (0.49) ALOX5PTGESPPARGMEN1ALDH1A1
SCHEMBL6367852 0.83 ALOX5 (0.58) ALOX5PTGESPPARGAPEX1MAPT

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-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 ALOX5 3216/4885PTGES 1450/4885PPARG 3455/4885

“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.