SCHEMBL368536

SCHEMBL368536

Cc1ccccc1C(CC(=O)c1ccc(=O)n(C)c1)c1ccc(C2CCN(C(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.43
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
GPR119 Q8TDV5 4/20 0.38
NPC1L1 Q9UHC9 1/20 0.38
USP30 Q70CQ3 1/20 0.37
APAF1 O14727 1/20 0.37
TP53 P04637 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HPGDS O60760 1/20 0.37
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
P2RY14 Q15391 1/20 0.36
MAPT P10636 1/20 0.36
SYK P43405 1/20 0.36
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36

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
SCHEMBL368537 1.00 NAMPT (0.43) NAMPTKDM4EPKMGPR119NPC1L1
SCHEMBL1389915 0.91 GPBAR1 (0.44) NAMPTKDM4EPKMGPR119NPC1L1
SCHEMBL1389918 0.91 GPBAR1 (0.44) NAMPTKDM4EPKMGPR119NPC1L1
SCHEMBL1389920 0.91 GPBAR1 (0.44) NAMPTKDM4EPKMGPR119NPC1L1
SCHEMBL1389917 0.91 GPBAR1 (0.44) NAMPTKDM4EPKMGPR119NPC1L1
SCHEMBL371362 0.89 APAF1 (0.41) APAF1MEN1KMT2A
SCHEMBL368174 0.88 APAF1 (0.40) APAF1MEN1KMT2A
SCHEMBL368175 0.88 APAF1 (0.40) APAF1MEN1KMT2A
SCHEMBL370010 0.85 GPR119 (0.44) NAMPTKDM4EPKMGPR119NPC1L1
SCHEMBL370011 0.85 GPR119 (0.44) NAMPTKDM4EPKMGPR119NPC1L1

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
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 NAMPT 4092/4885KDM4E 4298/4885PKM 1994/4885

“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.