SCHEMBL370144

SCHEMBL370144

Cn1cc(/C(CC(c2ccc(C(=O)NC[C@@H](O)CO)cc2)c2ccc(Cl)cc2F)=N\O)ccc1=O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.33
GPBAR1 Q8TDU6 1/20 0.33
TP53 P04637 3/20 0.33
GCG P01275 1/20 0.32
S1PR3 Q99500 4/20 0.32
S1PR1 P21453 2/20 0.32
F9 P00740 1/20 0.32
PRMT5 O14744 3/20 0.31
MDM2 Q00987 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
SCHEMBL370146 1.00 MAPK14 (0.33) MAPK14GPBAR1TP53GCGS1PR3
SCHEMBL370145 1.00 MAPK14 (0.33) MAPK14GPBAR1TP53GCGS1PR3
SCHEMBL370143 1.00 MAPK14 (0.33) MAPK14GPBAR1TP53GCGS1PR3
SCHEMBL369579 0.91 GPBAR1 (0.35) MAPK14GPBAR1TP53GCGF9
SCHEMBL369578 0.91 GPBAR1 (0.35) MAPK14GPBAR1TP53GCGF9
SCHEMBL369576 0.91 GPBAR1 (0.35) MAPK14GPBAR1TP53GCGF9
SCHEMBL369577 0.91 GPBAR1 (0.35) MAPK14GPBAR1TP53GCGF9
SCHEMBL368689 0.90 MAPK14 (0.36) MAPK14TP53GCGS1PR3S1PR1
SCHEMBL1390322 0.90 MAPK14 (0.36) MAPK14TP53GCGS1PR3S1PR1
SCHEMBL1390081 0.90 GCG (0.37) GPBAR1GCGS1PR3S1PR1MDM2

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
EP-2593426-B1 1-HYDROXYIMINO-3-PHENYL-PROPANES HOFFMANN LA ROCHE (CH) 2014-08-20 EP claimed
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 MAPK14 3679/4885GPBAR1 1/4885TP53 4233/4885

“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.