SCHEMBL16197875

SCHEMBL16197875

CC(=O)OC(CNC(=O)O)CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 2/20 0.42
THRB P10828 1/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
MAPK1 P28482 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL16197599 1.00 KMT2A (0.43) KMT2AALDH1A1MEN1THRBCA12
SCHEMBL5810977 0.81 ALDH1A1 (0.47) KMT2AALDH1A1MEN1CA12CA9
SCHEMBL5795257 0.81 ALDH1A1 (0.47) KMT2AALDH1A1MEN1CA12CA9
SCHEMBL5794609 0.81 ALDH1A1 (0.47) KMT2AALDH1A1MEN1CA12CA9
SCHEMBL5794605 0.81 ALDH1A1 (0.47) KMT2AALDH1A1MEN1CA12CA9
SCHEMBL5796319 0.81 ALDH1A1 (0.47) KMT2AALDH1A1MEN1CA12CA9
SCHEMBL5810973 0.81 ALDH1A1 (0.47) KMT2AALDH1A1MEN1CA12CA9
SCHEMBL23089859 0.79 ALDH1A1 (0.48) KMT2AALDH1A1MEN1THRBCA12
SCHEMBL16197755 0.79 ALDH1A1 (0.57) KMT2AALDH1A1MEN1THRBCA12
SCHEMBL15571180 0.79 ALDH1A1 (0.57) KMT2AALDH1A1MEN1THRBCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2989097-A1 IMPROVED PROCESSES FOR THE PREPARATION OF LINEZOLID USING NOVEL INTERMEDIATES Symed Labs Limited (IN) 2016-03-02 EP claimed
WO-2014174522-A1 IMPROVED PROCESSES FOR THE PREPARATION OF LINEZOLID USING NOVEL INTERMEDIATES SYMED LABS LIMITED (IN) 2014-10-30 WO claimed
EP-2989097-A1 IMPROVED PROCESSES FOR THE PREPARATION OF LINEZOLID USING NOVEL INTERMEDIATES Symed Labs Limited (IN) 2016-03-02 EP disclosed
WO-2014174522-A1 IMPROVED PROCESSES FOR THE PREPARATION OF LINEZOLID USING NOVEL INTERMEDIATES SYMED LABS LIMITED (IN) 2014-10-30 WO disclosed