SCHEMBL362406

SCHEMBL362406

O=C(CC(c1ccccc1)c1ccccc1)c1cc(F)ncc1Cl

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
EPHX2 P34913 1/20 0.40
TACR1 P25103 3/20 0.38
P2RX7 Q99572 6/20 0.37
CTSA P10619 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
DCAF1 Q9Y4B6 1/20 0.35
ALPL P05186 1/20 0.35
ALOX15 P16050 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
SCHEMBL1390144 0.83 BRD4 (0.43) HTTNPSR1EPHX2TACR1CTSA
SCHEMBL10240932 0.81 GPBAR1 (0.38) HTTNPSR1EPHX2TACR1P2RX7
SCHEMBL364368 0.81 GPBAR1 (0.38) HTTNPSR1EPHX2TACR1P2RX7
SCHEMBL364369 0.81 GPBAR1 (0.38) HTTNPSR1EPHX2TACR1P2RX7
SCHEMBL1390097 0.81 GPBAR1 (0.42) P2RX7CTSAKMT2A
SCHEMBL364123 0.79 GPBAR1 (0.52) CTSA
SCHEMBL15949745 0.79 GPBAR1 (0.52) CTSA
SCHEMBL363060 0.78 NPSR1 (0.42) HTTNPSR1EPHX2TACR1P2RX7
SCHEMBL1395402 0.69 BRD4 (0.36) CTSAMEN1KMT2A
SCHEMBL1389992 0.69 GPBAR1 (0.44) NPSR1CTSAMEN1KMT2A

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 6 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
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 HTT 1564/4885NPSR1 319/4885EPHX2 1909/4885

“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.