SCHEMBL28064084

SCHEMBL28064084

O=C(Cc1cncs1)ON1CCC(CCOc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 1/20 0.47
TEAD3 Q99594 1/20 0.47
LTA4H P09960 1/20 0.38
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
PARP15 Q460N3 1/20 0.36
PARP10 Q53GL7 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
TDP1 Q9NUW8 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
SCHEMBL28064087 0.96 TEAD1 (0.44) TEAD1TEAD3LTA4HPARP15PARP10
SCHEMBL28064128 0.92 TEAD1 (0.40) TEAD1TEAD3PPARGPPARDPPARA
SCHEMBL28064086 0.90 LTA4H (0.39) TEAD1TEAD3LTA4HPARP15PARP10
SCHEMBL28064060 0.90 LTA4H (0.39) TEAD1TEAD3LTA4HPPARGPPARD
SCHEMBL28064068 0.88 PARP10 (0.53) TEAD1TEAD3LTA4HPARP15PARP10
SCHEMBL28064070 0.88 LTA4H (0.39) TEAD1TEAD3LTA4HPARP15PARP10
SCHEMBL28064102 0.86 KDM4E (0.41) TEAD1TEAD3ALDH1A1LMNA
SCHEMBL28064069 0.86 PPARG (0.37) TEAD1TEAD3LTA4HPPARGPPARD
SCHEMBL28064081 0.84 PTGDR2 (0.40) PPARG
SCHEMBL28064163 0.83 ALDH1A1 (0.38) PPARGPPARDPPARAALDH1A1

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