SCHEMBL363622

SCHEMBL363622

CON(C)C(=O)CC(c1ccc(Br)cc1)c1ccc(F)cc1C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.40
MAPT P10636 5/20 0.37
NPSR1 Q6W5P4 4/20 0.37
TDP1 Q9NUW8 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
ALDH1A1 P00352 6/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PKM P14618 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 2/20 0.33
GAA P10253 1/20 0.33
PPARG P37231 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
SCHEMBL362237 0.90 HPGD (0.41) HPGDMAPTNPSR1TDP1SMN1; SMN2
SCHEMBL363757 0.86 LMNA (0.41) MAPTNPSR1TDP1SMN1; SMN2LMNA
SCHEMBL366084 0.86 LMNA (0.41) MAPTNPSR1TDP1SMN1; SMN2LMNA
SCHEMBL362061 0.83 GPBAR1 (0.46) HPGDMAPTNPSR1TDP1SMN1; SMN2
SCHEMBL362062 0.83 GPBAR1 (0.46) HPGDMAPTNPSR1TDP1SMN1; SMN2
SCHEMBL362134 0.83 GPBAR1 (0.46) HPGDMAPTNPSR1TDP1SMN1; SMN2
SCHEMBL362679 0.83 KEAP1 (0.43) MAPTMEN1KMT2AALDH1A1KEAP1
SCHEMBL1395398 0.79 TDP1 (0.43) HPGDMAPTNPSR1TDP1SMN1; SMN2
SCHEMBL15949106 0.75 KMT2A (0.44) MAPTNPSR1TDP1SMN1; SMN2LMNA
SCHEMBL363625 0.75 TACR1 (0.40) HPGDMAPTNPSR1TDP1SMN1; SMN2

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 HPGD 602/4885MAPT 4149/4885NPSR1 319/4885

“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.