SCHEMBL28064078

SCHEMBL28064078

O=C(Cc1cscn1)ON1CCC(CCOc2ccc(Oc3ccccc3)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 1/20 0.45
TEAD3 Q99594 1/20 0.45
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
LTA4H P09960 1/20 0.36
CSF1R P07333 1/20 0.36
KDR P35968 1/20 0.36
CHRM4 P08173 2/20 0.36
PPARA Q07869 2/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 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
SCHEMBL28064082 0.94 KDM4E (0.41) TEAD1TEAD3KDM4EALDH1A1LMNA
SCHEMBL28827928 0.89 MEN1 (0.39) TEAD1TEAD3LTA4H
SCHEMBL28064062 0.88 RAB9A (0.39) TEAD1TEAD3ALDH1A1LMNALTA4H
SCHEMBL28064080 0.86 HRH3 (0.39) TEAD1TEAD3LMNALTA4H
SCHEMBL28064072 0.83 ALDH1A1 (0.39) TEAD1TEAD3KDM4EALDH1A1CHRM4
SCHEMBL28064077 0.83 KDM4E (0.44) TEAD1TEAD3KDM4EALDH1A1
SCHEMBL28064087 0.82 TEAD1 (0.44) TEAD1TEAD3LTA4HCSF1RKDR
SCHEMBL2228891 0.81 TEAD1 (0.50) TEAD1TEAD3CSF1RKDRCHRM4
SCHEMBL28064089 0.80 PTGDR2 (0.40) PPARG
SCHEMBL28064071 0.79 ALDH1A1 (0.38) KDM4EALDH1A1LMNAPPARAPPARG

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