SCHEMBL10240972

SCHEMBL10240972

COC(=O)c1ccc(-c2ccc(C(C/C(=N\O)c3ccnc(C)c3)c3ccccc3C)cc2)cc1Cl

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 6/20 0.72
CTSA P10619 6/20 0.37
F9 P00740 2/20 0.37
FTO Q9C0B1 1/20 0.36
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35
NR3C2 P08235 1/20 0.35
PDK2 Q15119 1/20 0.35
GCK P35557 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
SCHEMBL1389863 1.00 GPBAR1 (0.72) GPBAR1CTSAF9FTOPSEN1
SCHEMBL362653 1.00 GPBAR1 (0.72) GPBAR1CTSAF9FTOPSEN1
SCHEMBL10240974 0.91 GPBAR1 (0.80) GPBAR1CTSAF9FTOPSEN1
SCHEMBL1389556 0.91 GPBAR1 (0.80) GPBAR1CTSAF9FTOPSEN1
SCHEMBL364162 0.91 GPBAR1 (0.80) GPBAR1CTSAF9FTOPSEN1
SCHEMBL362410 0.90 GPBAR1 (0.56) GPBAR1CTSAF9FTOPSEN1
SCHEMBL363564 0.90 GPBAR1 (0.82) GPBAR1CTSAPSEN1PSEN2APH1B
SCHEMBL1390117 0.90 GPBAR1 (0.82) GPBAR1CTSAPSEN1PSEN2APH1B
SCHEMBL10240953 0.90 GPBAR1 (0.82) GPBAR1CTSAPSEN1PSEN2APH1B
SCHEMBL15949168 0.88 GPBAR1 (0.71) GPBAR1CTSAFTOPSEN1PSEN2

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
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
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 1/4885CTSA 3225/4885F9 4573/4885

“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.