SCHEMBL29707348

SCHEMBL29707348

CC(C)(C)OC(=O)N1CCC(c2ccc(CO)cc2Cl)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.51
STS P08842 3/20 0.48
MAPT P10636 2/20 0.48
KDM4E B2RXH2 1/20 0.48
THRB P10828 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CNR1 P21554 2/20 0.46
TP53 P04637 2/20 0.45
GRM5 P41594 2/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
USP2 O75604 1/20 0.44
HPGD P15428 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL19212180 1.00 GPR119 (0.51) GPR119STSMAPTKDM4ETHRB
SCHEMBL19212385 0.88 STS (0.46) GPR119STSMAPTKDM4ETHRB
SCHEMBL29707368 0.88 STS (0.46) GPR119STSMAPTKDM4ETHRB
SCHEMBL19212420 0.87 GPR119 (0.54) GPR119STSMAPTKDM4ETHRB
SCHEMBL29707387 0.87 GPR119 (0.54) GPR119STSMAPTKDM4ETHRB
SCHEMBL19092639 0.86 GPR119 (0.51) GPR119MAPTKDM4ETHRBSMN1; SMN2
SCHEMBL4786221 0.85 CNR1 (0.56) STSMAPTKDM4ETHRBSMN1; SMN2
SCHEMBL28689001 0.85 GPR119 (0.46) GPR119STSSMN1; SMN2CNR1TP53
SCHEMBL28673691 0.85 GPR119 (0.49) GPR119STSMAPTKDM4ETHRB
SCHEMBL17398495 0.84 ESR2 (0.52) GPR119STSMAPTKDM4ETHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3414252-B1 THIENOPYRIDINE CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS VALO HEALTH INC (US) 2022-07-06 EP disclosed