SCHEMBL368917

SCHEMBL368917

COC(=O)CCCOc1ccc(C(CC(=O)c2ccc(=O)n(C)c2)c2ccc(Cl)cc2C)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
FFAR1 O14842 8/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
CNR1 P21554 1/20 0.35
GAA P10253 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
PDE3B Q13370 2/20 0.35
PDE3A Q14432 2/20 0.35
PDE2A O00408 1/20 0.35
P2RY12 Q9H244 1/20 0.35
PLA2G4A P47712 1/20 0.34

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
SCHEMBL368768 0.92 FFAR1 (0.40) FFAR1L3MBTL1CNR1PLA2G4A
SCHEMBL368732 0.88 MAPT (0.42) MAPTGAACYP1A2CYP3A4CYP2D6
SCHEMBL368916 0.85 PPARG (0.38) FFAR1L3MBTL1GAAPLA2G4A
SCHEMBL1390419 0.85 LMNA (0.43) MAPTFFAR1L3MBTL1CYP1A2CYP2C19
SCHEMBL10291021 0.84 FFAR1 (0.39) FFAR1L3MBTL1CNR1PLA2G4A
SCHEMBL369581 0.83 POLB (0.40) FFAR1L3MBTL1GAACYP2C19
SCHEMBL363355 0.83 FFAR1 (0.38) FFAR1CNR1PLA2G4A
SCHEMBL363356 0.83 FFAR1 (0.38) FFAR1CNR1PLA2G4A
SCHEMBL371309 0.82 POLB (0.40) FFAR1L3MBTL1GAACYP2C19
SCHEMBL15832896 0.81 POLB (0.39) FFAR1L3MBTL1GAACYP3A4CYP2C19

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 MAPT 4149/4885FFAR1 14/4885L3MBTL1 2596/4885

“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.