SCHEMBL28064087

SCHEMBL28064087

O=C(Cc1cncs1)ON1CCC(CCOc2ccc(Oc3ccccc3)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 1/20 0.44
TEAD3 Q99594 1/20 0.44
LTA4H P09960 1/20 0.37
CSF1R P07333 1/20 0.37
KDR P35968 1/20 0.37
P2RX7 Q99572 1/20 0.36
FAAH O00519 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
PARP15 Q460N3 1/20 0.36
PARP10 Q53GL7 1/20 0.36

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
SCHEMBL28064084 0.96 TEAD1 (0.47) TEAD1TEAD3LTA4HPARP15PARP10
SCHEMBL28064128 0.94 TEAD1 (0.40) TEAD1TEAD3CSF1RKDRFAAH
SCHEMBL28064086 0.89 LTA4H (0.39) TEAD1TEAD3LTA4HPARP15PARP10
SCHEMBL28064060 0.89 LTA4H (0.39) TEAD1TEAD3LTA4HHRH3PARP15
SCHEMBL28064068 0.87 PARP10 (0.53) TEAD1TEAD3LTA4HHRH3PARP15
SCHEMBL28064070 0.86 LTA4H (0.39) TEAD1TEAD3LTA4HHRH3PARP15
SCHEMBL28064102 0.83 KDM4E (0.41) TEAD1TEAD3
SCHEMBL28064069 0.83 PPARG (0.37) TEAD1TEAD3LTA4HHRH3
SCHEMBL28064078 0.82 TEAD1 (0.45) TEAD1TEAD3LTA4HCSF1RKDR
SCHEMBL2228411 0.81 TEAD1 (0.49) TEAD1TEAD3CSF1RKDRFAAH

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-102803258-B Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SAI NUOFEI (FR) 2016-04-20 CN claimed
CN-105837565-A ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION 赛诺菲 2016-08-10 CN disclosed
CN-102803258-B Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SAI NUOFEI (FR) 2016-04-20 CN disclosed