SCHEMBL7899134

SCHEMBL7899134

CC(C)(C)OC(=O)N1C=C(I)CCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ESR2 Q92731 1/20 0.38
CTSK P43235 1/20 0.37
NR1H2 P55055 1/20 0.37
HPGD P15428 1/20 0.36
BTK Q06187 1/20 0.35
GPR119 Q8TDV5 1/20 0.35
STS P08842 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
MAPT P10636 2/20 0.34
EPHX1 P07099 1/20 0.34
KDM4E B2RXH2 1/20 0.34
THRB P10828 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 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
SCHEMBL14878683 0.81 USP2 (0.39) USP2SMN1; SMN2MEN1KMT2AESR2
SCHEMBL16583210 0.78 USP2 (0.39) USP2SMN1; SMN2MEN1KMT2AESR2
SCHEMBL31555840 0.78 ESR2 (0.39) USP2SMN1; SMN2MEN1KMT2AESR2
SCHEMBL975177 0.78 HPGD (0.37) USP2SMN1; SMN2MEN1KMT2AESR2
SCHEMBL4762097 0.75 USP2 (0.41) USP2SMN1; SMN2MEN1KMT2AESR2
SCHEMBL25047980 0.74 CTSK (0.39) USP2SMN1; SMN2MEN1KMT2AESR2
SCHEMBL31555855 0.74 BTK (0.47) MEN1KMT2AESR2BTKGPR119
SCHEMBL2980997 0.74 ESR2 (0.43) USP2SMN1; SMN2MEN1KMT2AESR2
SCHEMBL17481737 0.74 USP2 (0.41) USP2SMN1; SMN2MEN1KMT2AESR2
SCHEMBL7863282 0.73 GLA (0.46) SMN1; SMN2MEN1KMT2ACTSKGPR119

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
WO-2010111634-A2 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-30 WO disclosed