SCHEMBL368212

SCHEMBL368212

Cc1cc(Cl)ccc1C(CC(=O)c1ccc(=O)n(C)c1)c1ccc(C(=O)NCCS(C)(=O)=O)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
MDM2 Q00987 1/20 0.36
LMNA P02545 2/20 0.35
EPHX2 P34913 5/20 0.34
GCGR P47871 3/20 0.34
GCG P01275 1/20 0.34
POLB P06746 2/20 0.33
CYP11B2 P19099 1/20 0.33
CREBBP Q92793 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GIPR P48546 1/20 0.33
BRD4 O60885 1/20 0.33

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
SCHEMBL369981 0.91 EPHX2 (0.38) TP53MDM2LMNAEPHX2GCGR
SCHEMBL369285 0.90 GPBAR1 (0.36) TP53MDM2LMNAEPHX2GCGR
SCHEMBL369286 0.90 GPBAR1 (0.36) TP53MDM2LMNAEPHX2GCGR
SCHEMBL369287 0.90 GPBAR1 (0.36) TP53MDM2LMNAEPHX2GCGR
SCHEMBL368555 0.90 GCG (0.37) LMNAEPHX2GCGRGCGPOLB
SCHEMBL369714 0.88 EPHX2 (0.38) LMNAEPHX2POLBBRD4
SCHEMBL370157 0.85 GPBAR1 (0.39) EPHX2POLBBRD4
SCHEMBL1390555 0.84 KDM4E (0.38) LMNAPOLBCREBBPBRD4
SCHEMBL1390515 0.84 MAPK14 (0.35) TP53LMNAEPHX2GCGPOLB
SCHEMBL369230 0.84 MAPK14 (0.35) TP53LMNAEPHX2GCGPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593426-B1 1-HYDROXYIMINO-3-PHENYL-PROPANES HOFFMANN LA ROCHE (CH) 2014-08-20 EP disclosed
US-8765730-B2 1-hydroxyimino-3-phenyl-propanes Hoffmann-La Roche Inc (US) 2014-07-01 US disclosed
EP-2593426-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F.HOFFMANN-LA ROCHE AG (CH) 2013-05-22 EP disclosed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 WO disclosed
US-20120010190-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-12 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-20120010190-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES GPBAR1, GPR119, ADRB1 TP53 4233/4885MDM2 3541/4885LMNA 2651/4885

“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.