SCHEMBL1390307

SCHEMBL1390307

Cc1ccccc1C(CC(=O)c1ccc(=O)n(C)c1)c1ccc(C(=O)N(C)CCO)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 8/20 0.39
GPBAR1 Q8TDU6 4/20 0.38
USP1 O94782 2/20 0.37
PIK3CA P42336 2/20 0.35
PIK3CB P42338 2/20 0.35
HDAC6 Q9UBN7 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CG P48736 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
SCHEMBL1390436 0.89 BRD4 (0.40) BRD4GPBAR1MGAMGAASI
SCHEMBL1390239 0.89 GPBAR1 (0.48) BRD4GPBAR1USP1PIK3CAPIK3CB
SCHEMBL1390451 0.89 GPBAR1 (0.48) BRD4GPBAR1USP1PIK3CAPIK3CB
SCHEMBL1390176 0.87 BRD4 (0.40) BRD4GPBAR1
SCHEMBL14891644 0.85 BRD4 (0.45) BRD4GPBAR1MGAMGAASI
SCHEMBL14891642 0.85 BRD4 (0.45) BRD4GPBAR1MGAMGAASI
SCHEMBL1390094 0.85 GPBAR1 (0.45) BRD4GPBAR1L3MBTL1MGAMGAA
SCHEMBL369733 0.83 GPBAR1 (0.54) BRD4GPBAR1MGAMGAASI
SCHEMBL369140 0.83 GPBAR1 (0.54) BRD4GPBAR1MGAMGAASI
SCHEMBL369139 0.83 GPBAR1 (0.54) BRD4GPBAR1MGAMGAASI

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 3 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-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 BRD4 3540/4885GPBAR1 1/4885USP1 2681/4885

“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.