SCHEMBL13655013

SCHEMBL13655013

CN1CCC(C(=O)NI)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.39
PKM P14618 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HTT P42858 1/20 0.36
GSK3B P49841 3/20 0.36
DYRK1A Q13627 3/20 0.36
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
CCNA1 P78396 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
ROCK2 O75116 1/20 0.35
WNT1 P04628 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.34
HTR1A P08908 1/20 0.34

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
SCHEMBL761339 0.80 ALDH1A1 (0.45) MKNK1PKMALDH1A1MEN1KMT2A
SCHEMBL22078923 0.80 HDAC8 (0.54) MKNK1PKMALDH1A1MEN1KMT2A
SCHEMBL26484713 0.78 MKNK1 (0.39) MKNK1PKMALDH1A1MEN1KMT2A
SCHEMBL4056944 0.78 MKNK1 (0.39) MKNK1PKMALDH1A1MEN1KMT2A
SCHEMBL13476038 0.78 HDAC8 (0.42) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL10139268 0.78
SCHEMBL12849688 0.77 MAPK1 (0.47) ALDH1A1MEN1KMT2ALMNAGAA
SCHEMBL14010048 0.77 MKNK1 (0.38) MKNK1PKMALDH1A1MEN1KMT2A
SCHEMBL13783322 0.77 MAPK1 (0.53) ALDH1A1MEN1KMT2ALMNAGAA
SCHEMBL20159607 0.77 L3MBTL1 (0.51) ALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020160054-A1 IMIDAZOQUINOLINE AMINE DERIVATIVES, PHARMACEUTICAL COMPOSITION, USE THEREOF CANWELL BIOTECH LIMITED (CN) 2020-08-06 WO disclosed
WO-2017095904-A1 HETEROBIFUNCTIONAL PAN-SELECTIN ANTAGONISTS HAVING A TRIAZOLE LINKER GLYCOMIMETICS, INC. (US) 2017-06-08 WO disclosed
EP-1971601-B1 N4-PHENYL-QUINAZOLINE-4 -AMINE DERIVATIVES AND RELATED COMPOUNDS AS ERBB TYPE I RECEPTOR TYROSINE KINASE INHIBITORS FOR THE TREATMENT OF HYPERPROLIFERATIVE DISEASES ARRAY BIOPHARMA INC (US) 2009-10-21 EP disclosed