SCHEMBL17320280

SCHEMBL17320280

CCC(C)(C)C(=O)NCC1COC(C)O1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.38
CHRM5 P08912 2/20 0.38
CHRM1 P11229 2/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
KDM4E B2RXH2 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM3 P20309 1/20 0.37
HTT P42858 1/20 0.37
RIPK1 Q13546 4/20 0.36
CNR2 P34972 4/20 0.33
CNR1 P21554 2/20 0.33
CCR2 P41597 1/20 0.31

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
SCHEMBL13854070 0.87 RIPK1 (0.41) RIPK1CNR2CNR1CCR2
SCHEMBL13641788 0.73 ALDH1A1 (0.38) CHRM2CHRM5CHRM1TSHRMAPK1
SCHEMBL13854074 0.72 RIPK1 (0.40) RIPK1CNR2CNR1CCR2
SCHEMBL16021071 0.72 ALDH1A1 (0.44) CHRM2CHRM5CHRM1TSHRMAPK1
SCHEMBL22823135 0.72 MTNR1A (0.34) MAPK1
SCHEMBL14566237 0.72 SMN1; SMN2 (0.44) TSHRMAPK1RIPK1CCR2
SCHEMBL16020223 0.72 MTNR1A (0.40) TSHRMAPK1HTTRIPK1CNR2
SCHEMBL25506306 0.71 PREP (0.37) TSHRMAPK1
SCHEMBL13662648 0.70 TDP1 (0.47) RIPK1CNR2CNR1CCR2
SCHEMBL17929913 0.67 EPHX1 (0.47) RIPK1CNR2CNR1CCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160252818-A9 PRODUCTION METHOD OF SEMICONDUCTOR ELEMENT, AND ION IMPLANTATION METHOD JSR CORPORATION (JP) 2016-09-01 US disclosed
US-20150355550-A1 PRODUCTION METHOD OF SEMICONDUCTOR ELEMENT, AND ION IMPLANTATION METHOD JSR CORPORATION (JP) 2015-12-10 US disclosed