SCHEMBL10933892

SCHEMBL10933892

N#CC(C#N)=C1C=[C]CCC1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.33
USP2 O75604 4/20 0.33
LMNA P02545 4/20 0.33
HTT P42858 4/20 0.33
KMT2A Q03164 4/20 0.33
MAPT P10636 3/20 0.33
POLB P06746 2/20 0.33
RECQL P46063 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 1/20 0.33
BLM P54132 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GPR55 Q9Y2T6 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
SCHEMBL24798951 0.64 EGFR (0.34) MEN1USP2LMNAHTTKMT2A
SCHEMBL11199502 0.64 GAA (0.33)
SCHEMBL14613101 0.64 MEN1 (0.41) MEN1USP2LMNAHTTKMT2A
SCHEMBL29141813 0.64 ALDH1A1 (0.38) MEN1USP2LMNAHTTKMT2A
SCHEMBL16977319 0.62 MEN1 (0.36) MEN1USP2LMNAHTTKMT2A
SCHEMBL14612944 0.59 EGFR (0.30)
SCHEMBL20647235 0.59 MEN1 (0.34) MEN1USP2LMNAHTTKMT2A
SCHEMBL19911229 0.59 MEN1 (0.34) MEN1USP2LMNAHTTKMT2A
SCHEMBL8701602 0.59 MEN1 (0.34) MEN1USP2LMNAHTTKMT2A
SCHEMBL213528 0.58

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
JP-60025961-A None JP disclosed
JP-S6025961-A DICYANOMETHYLENECYCLOHEXAN-4-ONE AND ITS PREPARATION TOYO SODA MFG CO LTD 1985-02-08 JP disclosed