SCHEMBL1390281

SCHEMBL1390281

Cc1cc(/C(CC(c2ccc(-c3ccc(C(=O)O)cc3)cc2)c2ccccc2C)=N\O)cc(C)n1

nearest known ligand 0.80

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 6/20 0.80
CHEK2 O96017 1/20 0.38
CTSA P10619 3/20 0.37
NR1H4 Q96RI1 1/20 0.37
VCP P55072 3/20 0.36
MLKL Q8NB16 1/20 0.36
RXRA P19793 2/20 0.36
RXRB P28702 2/20 0.36
RXRG P48443 1/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL370898 1.00 GPBAR1 (0.80) GPBAR1CHEK2CTSANR1H4VCP
SCHEMBL363226 1.00 GPBAR1 (0.80) GPBAR1CHEK2CTSANR1H4VCP
SCHEMBL370900 1.00 GPBAR1 (0.80) GPBAR1CHEK2CTSANR1H4VCP
SCHEMBL1389928 0.90 GPBAR1 (0.71) GPBAR1CHEK2CTSANR1H4MLKL
SCHEMBL363133 0.90 GPBAR1 (0.71) GPBAR1CHEK2CTSANR1H4MLKL
SCHEMBL1389926 0.90 GPBAR1 (0.71) GPBAR1CHEK2CTSANR1H4MLKL
SCHEMBL1389923 0.90 GPBAR1 (0.71) GPBAR1CHEK2CTSANR1H4MLKL
SCHEMBL1389585 0.89 GPBAR1 (1.00) GPBAR1CHEK2CTSARXRARXRB
SCHEMBL364261 0.89 GPBAR1 (1.00) GPBAR1CHEK2CTSARXRARXRB
SCHEMBL364009 0.89 GPBAR1 (1.00) GPBAR1CHEK2CTSARXRARXRB

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 1/4885CHEK2 4843/4885CTSA 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.