SCHEMBL16190055

SCHEMBL16190055

CCC1(OC(=O)C23CC4CC(C2)CC(C(=S)OC2(CC)C5CC6CC(C5)CC2C6)(C4)C3)C2CC3CC(C2)CC1C3

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.41
SCN1A P35498 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 2/20 0.35
PKM P14618 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 3/20 0.34
HSD11B1 P28845 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
ABL1 P00519 1/20 0.32
TSHR P16473 1/20 0.32
RIN1 Q13671 1/20 0.32

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
SCHEMBL4710809 0.92 NPSR1 (0.47) NPSR1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL21262939 0.82 SCN1A (0.50) NPSR1SCN1ASCN2ASCN3ALMNA
SCHEMBL4713572 0.82 NPSR1 (0.43) NPSR1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL4709960 0.80 NPSR1 (0.43) NPSR1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL4709385 0.80 NPSR1 (0.42) NPSR1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL4709422 0.79 NPSR1 (0.43) NPSR1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL4713269 0.79 NPSR1 (0.42) NPSR1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL4711412 0.79 NPSR1 (0.42) NPSR1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL4712592 0.79 NPSR1 (0.42) NPSR1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL4710775 0.78 NPSR1 (0.41) NPSR1SCN1ASCN2ASCN3ASMN1; SMN2

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-2014171429-A1 PRODUCTION METHOD FOR SEMICONDUCTOR ELEMENT AND ION IMPLANTATION METHOD JSR株式会社 (JP) 2014-10-23 WO disclosed