SCHEMBL1389828

SCHEMBL1389828

Cc1ccccc1C(CC(=NO)c1cc(F)ccc1F)c1ccc(Br)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 7/20 0.53
DPP4 P27487 1/20 0.35
CTSA P10619 8/20 0.34
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL1389826 1.00 GPBAR1 (0.53) GPBAR1DPP4CTSAKDM4EALDH1A1
SCHEMBL363939 1.00 GPBAR1 (0.53) GPBAR1DPP4CTSAKDM4EALDH1A1
SCHEMBL363684 0.88 GPBAR1 (0.52) GPBAR1CTSA
SCHEMBL1389682 0.88 GPBAR1 (0.52) GPBAR1CTSA
SCHEMBL1389684 0.88 GPBAR1 (0.52) GPBAR1CTSA
SCHEMBL1390023 0.84 GPBAR1 (0.43) GPBAR1DPP4CTSAALDH1A1MAPT
SCHEMBL1390174 0.83 GPBAR1 (0.56) GPBAR1CTSAKDM4EALDH1A1MAPT
SCHEMBL364013 0.83 GPBAR1 (0.56) GPBAR1CTSAKDM4EALDH1A1MAPT
SCHEMBL1390173 0.83 GPBAR1 (0.56) GPBAR1CTSAKDM4EALDH1A1MAPT
SCHEMBL363807 0.83 GPBAR1 (0.52) GPBAR1CTSA

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 4 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
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 GPBAR1 1/4885DPP4 817/4885CTSA 3225/4885

“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.