SCHEMBL19861332

SCHEMBL19861332

CCN1CCN(CCC[C@H](CCO)CCC(C)(C)C)CC1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 2/20 0.32
HTT P42858 1/20 0.32
ALDH1A1 P00352 3/20 0.30
MEN1 O00255 1/20 0.30
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
THRB P10828 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL19861296 0.91 LMNA (0.30) KMT2ALMNAHTT
SCHEMBL15183543 0.89 LMNA (0.35) USP2KMT2ALMNAALDH1A1MEN1
SCHEMBL15183540 0.89 LMNA (0.35) USP2KMT2ALMNAALDH1A1MEN1
SCHEMBL19861221 0.89 CHRM4 (0.39) USP2KMT2ALMNAHTTALDH1A1
SCHEMBL17524046 0.89 USP2 (0.34) USP2
SCHEMBL17524047 0.89 USP2 (0.34) USP2
SCHEMBL17523838 0.86 USP2 (0.33) USP2KMT2ALMNAHTTALDH1A1
SCHEMBL17523839 0.86 USP2 (0.33) USP2KMT2ALMNAHTTALDH1A1
SCHEMBL17523885 0.85 LMNA (0.38) USP2KMT2ALMNAALDH1A1MEN1
SCHEMBL17523886 0.85 LMNA (0.38) USP2KMT2ALMNAALDH1A1MEN1

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-9890198-B2 Cyclosporin derivatives and uses thereof S&T GLOBAL INC. (US) 2018-02-13 US disclosed