SCHEMBL2228689

SCHEMBL2228689

O=C(OCc1cscn1)N1CCC(COc2ccc(Cl)c(Cl)c2)C1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
GRM5 P41594 1/20 0.41
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
CHRNA7 P36544 1/20 0.39
GRIN2B Q13224 2/20 0.37
ENPP2 Q13822 4/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 1/20 0.36
MGLL Q99685 1/20 0.35
F2 P00734 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 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
SCHEMBL2229023 0.87 MMP2 (0.45) MMP2MMP9GRM5GRIN2BENPP2
SCHEMBL2228696 0.87 MMP2 (0.48) MMP2MMP9GRIN2BNPC1RAB9A
SCHEMBL2228470 0.87 MMP2 (0.47) MMP2MMP9GRIN2BENPP2NPC1
SCHEMBL2228990 0.85 MMP2 (0.46) MMP2MMP9GRIN2BENPP2NPC1
SCHEMBL2229360 0.84 MMP2 (0.43) MMP2MMP9GRIN2B
SCHEMBL2227253 0.84 MMP2 (0.43) MMP2MMP9GRIN2B
SCHEMBL2362512 0.83 MMP2 (0.43) MMP2MMP9GRIN2BMEN1KMT2A
SCHEMBL2286530 0.82 MMP2 (0.41) MMP2MMP9GRIN2BMGLL
SCHEMBL2228670 0.82 MMP2 (0.45) MMP2MMP9GRIN2BRAB9AMAPT
SCHEMBL2286508 0.80 MMP2 (0.48) MMP2MMP9GRIN2BMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105837565-A ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION 赛诺菲 2016-08-10 CN claimed
CN-105837565-A ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION 赛诺菲 2016-08-10 CN disclosed
WO-2011089550-A1 ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI AVENTIS (FR) 2011-07-28 WO disclosed