SCHEMBL28064067

SCHEMBL28064067

Cc1ccc(OCCC2CCN(OC(=O)Cc3cncs3)CC2)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.40
HPGD P15428 4/20 0.40
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
GLA P06280 1/20 0.40
ALDH1A1 P00352 3/20 0.39
KCNA5 P22460 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
MAPT P10636 3/20 0.35
PPARD Q03181 2/20 0.35
PPARA Q07869 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
LMNA P02545 1/20 0.35
PPARG P37231 1/20 0.35
HTT P42858 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
SCHEMBL28064079 0.88 KDM4E (0.39) KDM4EALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL28064102 0.83 KDM4E (0.41) KDM4EALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL28088219 0.83 PPARG (0.36) SMN1; SMN2PPARDPPARAPPARG
SCHEMBL28064075 0.83 KDM4E (0.39) KDM4EHPGDRAB9ANPC1GLA
SCHEMBL28064167 0.83 KCNA5 (0.46) KDM4EHPGDRAB9ANPC1GLA
SCHEMBL28088153 0.82 HRH3 (0.37) KDM4EHPGDRAB9ANPC1ALDH1A1
SCHEMBL2229121 0.82 GRIN2B (0.42) KDM4EHPGDRAB9ANPC1GLA
SCHEMBL28064203 0.82 PPARG (0.46) PPARDPPARAPPARG
SCHEMBL28064084 0.81 TEAD1 (0.47) ALDH1A1PPARDPPARALMNAPPARG
SCHEMBL28088222 0.81 PPARG (0.37) RAB9ANPC1KMT2AMEN1PPARD

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