SCHEMBL27627640

SCHEMBL27627640

CCN(C(=O)O)c1ccc(C(F)(F)F)cc1.CCOC(CCC(=O)O)NC

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MLYCD O95822 7/20 0.39
▸ HTT P42858 1/20 0.39
▸ TSHR P16473 1/20 0.38
▸ FFAR1 O14842 3/20 0.37
▸ PPARG P37231 1/20 0.37
▸ PPARD Q03181 2/20 0.35
▸ LMNA P02545 1/20 0.34
▸ GPR88 Q9GZN0 1/20 0.34

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
SCHEMBL27647851 0.85 FOLH1 (0.34) TSHR
SCHEMBL6229257 0.78 MLYCD (0.54) MLYCDHTTTSHR
SCHEMBL27647844 0.76 EPOR (0.41) FFAR1LMNA
SCHEMBL9819347 0.68 MLYCD (0.44) MLYCDFFAR1
SCHEMBL24795106 0.66 MLYCD (0.49) MLYCDHTTTSHRLMNA
SCHEMBL4044376 0.65 CES2 (0.44) MLYCD
SCHEMBL4630024 0.65 HSD11B1 (0.56) MLYCDHTTTSHR
SCHEMBL3418705 0.65 MLYCD (0.50) MLYCDHTTTSHR
SCHEMBL7837974 0.64 MLYCD (0.50) MLYCDHTTTSHR
SCHEMBL7670109 0.64 PTPN1 (0.49) MLYCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101058564-B Production of arylalkyl carbamate derivatives and their use in therapy SANOFI AVENTIS 2010-05-26 — — CN disclosed
CN-100506788-C Production of arylalkyl carbamate derivatives and their use in therapy SANOFI AVENTIS (FR) 2009-07-01 — — CN disclosed
CN-101058564-A Production of arylalkyl carbamate derivatives and their use in therapy SANOFI AVENTIS (FR) 2007-10-24 — — CN disclosed
CN-1741990-A Production of arylalkyl carbamate derivatives and their use in therapy SANOFI AVENTIS (FR) 2006-03-01 — — CN disclosed
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