SCHEMBL365670

SCHEMBL365670

COC(=O)c1ccc(C(CC(=O)c2c[nH]c(=O)c(C)c2)c2ccc(Cl)cc2C)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
GAA P10253 9/20 0.40
MGAM O43451 7/20 0.40
SI P14410 7/20 0.40
MGAM2 Q2M2H8 7/20 0.40
ALDH1A1 P00352 1/20 0.38
POLB P06746 2/20 0.38
RAB9A P51151 1/20 0.37
BRD4 O60885 1/20 0.37
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
CNR1 P21554 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 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
SCHEMBL364331 0.90 MGAM (0.43) L3MBTL1GAAMGAMSIMGAM2
SCHEMBL12505663 0.88 MGAM (0.41) L3MBTL1GAAMGAMSIMGAM2
SCHEMBL362297 0.84 MGAM (0.38) GAAMGAMSIMGAM2POLB
SCHEMBL362955 0.81 MGAM (0.38) GAAMGAMSIMGAM2
SCHEMBL370270 0.81 POLB (0.38) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL1390419 0.80 LMNA (0.43) L3MBTL1POLBCYP2C9CYP2C19LMNA
SCHEMBL365165 0.79 GPBAR1 (0.45) L3MBTL1GAAMGAMSIMGAM2
SCHEMBL365274 0.78 GPBAR1 (0.46) GAAMGAMSIMGAM2POLB
SCHEMBL369868 0.77 KMT2A (0.47) GAAMGAMSIMGAM2POLB
SCHEMBL363551 0.77 EGFR (0.35) L3MBTL1GAAMGAMSIMGAM2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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