SCHEMBL2365539

SCHEMBL2365539

CC(C)(C)c1cc(OCCC2CCN(C(=O)O)C(Cc3cscn3)C2)cc(C(C)(C)C)c1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 1/20 0.32
TEAD3 Q99594 1/20 0.32
PPARG P37231 2/20 0.32
PPARD Q03181 2/20 0.32
PPARA Q07869 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
RBP4 P02753 1/20 0.30

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
SCHEMBL2365457 0.84 LIPE (0.36) TEAD1TEAD3PPARDPPARA
SCHEMBL2365397 0.83 TEAD1 (0.32) TEAD1TEAD3PPARGPPARDPPARA
SCHEMBL2365569 0.82 KCNA5 (0.36) TEAD1TEAD3PPARGPPARDPPARA
SCHEMBL2363761 0.82 S1PR5 (0.41)
SCHEMBL2365562 0.81 FFAR1 (0.37) TEAD1TEAD3PPARGPPARDPPARA
SCHEMBL2365496 0.80 TEAD1 (0.36) TEAD1TEAD3MEN1KMT2A
SCHEMBL2365540 0.78 GRIN2B (0.42) TEAD1TEAD3
SCHEMBL2365258 0.78 ACKR3 (0.42) TEAD1TEAD3PPARDPPARA
SCHEMBL2365409 0.74 POLB (0.38) MEN1KMT2A
SCHEMBL2365536 0.67 LIPE (0.36) TEAD1TEAD3PPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011089550-A1 ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI AVENTIS (FR) 2011-07-28 WO claimed
WO-2011089550-A1 ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI AVENTIS (FR) 2011-07-28 WO disclosed