SCHEMBL17826600

SCHEMBL17826600

C[C@@H]1CN(C(=O)OC(C)(C)C)CCC1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.49
HPGD P15428 1/20 0.48
USP2 O75604 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GPR119 Q8TDV5 3/20 0.46
EPHX1 P07099 1/20 0.46
HSD17B10 Q99714 1/20 0.45
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 1/20 0.44
USP30 Q70CQ3 2/20 0.43
NR1H2 P55055 1/20 0.42
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
KDM4E B2RXH2 1/20 0.42
THRB P10828 1/20 0.42
PTPN2 P17706 1/20 0.42
PTPN1 P18031 1/20 0.42
PTPN6 P29350 1/20 0.42

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
SCHEMBL26347363 1.00 RECQL (0.49) RECQLHPGDUSP2SMN1; SMN2GPR119
SCHEMBL2158178 1.00 RECQL (0.49) RECQLHPGDUSP2SMN1; SMN2GPR119
SCHEMBL26924440 1.00 RECQL (0.49) RECQLHPGDUSP2SMN1; SMN2GPR119
SCHEMBL408313 1.00 RECQL (0.49) RECQLHPGDUSP2SMN1; SMN2GPR119
SCHEMBL2158173 1.00 RECQL (0.49) RECQLHPGDUSP2SMN1; SMN2GPR119
SCHEMBL21340034 0.98 RECQL (0.48) RECQLHPGDUSP2SMN1; SMN2GPR119
SCHEMBL4533115 0.89 HPGD (0.49) RECQLHPGDUSP2SMN1; SMN2GPR119
SCHEMBL4533109 0.89 HPGD (0.49) RECQLHPGDUSP2SMN1; SMN2GPR119
SCHEMBL4533108 0.89 HPGD (0.49) RECQLHPGDUSP2SMN1; SMN2GPR119
SCHEMBL25226719 0.87 HPGD (0.48) RECQLHPGDUSP2SMN1; SMN2GPR119

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
US-9365539-B2 Prolylcarboxypeptidase inhibitors MERCK SHARP & DOHME CORP. (US) 2016-06-14 US disclosed