SCHEMBL9550333

SCHEMBL9550333

CC1CCC2C(=O)N(C#N)C(=O)C2C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
LMNA P02545 3/20 0.40
RAB9A P51151 1/20 0.40
STAT3 P40763 1/20 0.37
ALDH1A1 P00352 7/20 0.36
GAA P10253 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PKM P14618 1/20 0.35
L3MBTL1 Q9Y468 4/20 0.33
KMT2A Q03164 3/20 0.33
MAPT P10636 3/20 0.33
MEN1 O00255 2/20 0.33
MAPK1 P28482 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
ABCB1 P08183 1/20 0.32
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HTT P42858 1/20 0.31
MT-CO2 P00403 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
SCHEMBL9906961 0.76 POLB (0.45) POLBLMNARAB9ASTAT3ALDH1A1
SCHEMBL9550311 0.76 ALDH1A1 (0.37) ALDH1A1GAAL3MBTL1KMT2AMEN1
SCHEMBL3199393 0.75 POLB (0.44) POLBLMNARAB9ASTAT3ALDH1A1
SCHEMBL17532439 0.72 POLB (0.42) POLBLMNARAB9ASTAT3ALDH1A1
SCHEMBL10335783 0.70 LMNA (0.43) POLBLMNARAB9ASTAT3ALDH1A1
SCHEMBL18485395 0.70 STAT3 (0.43) POLBLMNARAB9ASTAT3ALDH1A1
SCHEMBL18017060 0.68 POLB (0.40) POLBLMNARAB9ASTAT3ALDH1A1
SCHEMBL18485391 0.67 LMNA (0.41) POLBLMNARAB9ASTAT3ALDH1A1
SCHEMBL18485392 0.67 STAT3 (0.43) POLBLMNARAB9ASTAT3ALDH1A1
SCHEMBL14806792 0.67 POLB (0.38) POLBLMNARAB9ASTAT3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0484381-A1 N-CYANOIMIDES AND PROCESS FOR THEIR PREPARATION AND USES THEREOF HENKEL RESEARCH CORPORATION (US) 1992-05-13 EP claimed
WO-1991001307-A2 N-CYANOIMIDES AND PROCESS FOR THEIR PREPARATION AND USES THEREOF HENKEL RESEARCH CORPORATION (US) 1991-02-07 WO claimed
US-5216173-A Curing agents for epoxy resins; polyimides HENKEL RESEARCH CORPORATION (US) 1993-06-01 US disclosed
WO-1991001307-A2 N-CYANOIMIDES AND PROCESS FOR THEIR PREPARATION AND USES THEREOF HENKEL RESEARCH CORPORATION (US) 1991-02-07 WO disclosed