SCHEMBL28064208

SCHEMBL28064208

O=C(O)N1CCC(CCOc2ccc(F)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 1/20 0.57
TEAD3 Q99594 1/20 0.57
MEN1 O00255 1/20 0.54
POLB P06746 1/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
RAB9A P51151 1/20 0.48
HCRTR1 O43613 1/20 0.46
HCRTR2 O43614 1/20 0.46
KDM4E B2RXH2 1/20 0.45
GPR119 Q8TDV5 1/20 0.45

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
SCHEMBL3830625 0.87 TEAD1 (0.73) TEAD1TEAD3MEN1KMT2ASMN1; SMN2
SCHEMBL5208507 0.86 TEAD1 (0.57) TEAD1TEAD3MEN1POLBKMT2A
SCHEMBL13519209 0.86 MEN1 (0.56) MEN1POLBKMT2ASMN1; SMN2ALDH1A1
SCHEMBL28802165 0.84 TEAD1 (0.55) TEAD1TEAD3SMN1; SMN2ALDH1A1RAB9A
SCHEMBL4159824 0.83 GPR119 (0.65) GPR119
SCHEMBL3356937 0.83 TEAD1 (0.60) TEAD1TEAD3KMT2ASMN1; SMN2ALDH1A1
SCHEMBL5212355 0.83 TEAD1 (0.54) TEAD1TEAD3MEN1KMT2ASMN1; SMN2
SCHEMBL5231915 0.82 GRIN2B (0.57) TEAD1TEAD3MEN1POLBKMT2A
SCHEMBL4744702 0.82 TEAD1 (0.43) TEAD1TEAD3MEN1POLBKMT2A
SCHEMBL20744741 0.82 TEAD1 (0.53) TEAD1TEAD3MEN1POLBKMT2A

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-102803258-A Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SANOFI AVENTIS 2012-11-28 CN claimed
CN-102803258-B Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SAI NUOFEI (FR) 2016-04-20 CN disclosed