SCHEMBL20195221

SCHEMBL20195221

CCCc1ccc(C(=O)Nc2ccc3c(c2)c(N2CCOCC2)cc(=O)n3CC)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.47
MAPT P10636 7/20 0.47
KMT2A Q03164 7/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
LMNA P02545 4/20 0.47
MAPK1 P28482 4/20 0.47
HTT P42858 3/20 0.47
ALDH1A1 P00352 5/20 0.46
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
KDM4E B2RXH2 4/20 0.46
NPY5R Q15761 2/20 0.46
HPGD P15428 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
THRB P10828 1/20 0.45
POLB P06746 1/20 0.44
RECQL P46063 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ENPP2 Q13822 2/20 0.44
GAA P10253 1/20 0.43

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
SCHEMBL20183776 0.89 KMT2A (0.61) MEN1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL20183828 0.83 HIF1A (0.42) MEN1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL20354153 0.79 KMT2A (0.46) MEN1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL20183732 0.77 ENPP2 (0.47) MEN1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL20183704 0.77 MAPT (0.48) MEN1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL21473965 0.77 MAPT (0.51) MEN1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL23253945 0.76 MAPT (0.45) MEN1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL21549485 0.76 MAPT (0.47) MEN1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL20183715 0.75 HIF1A (0.43) MEN1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL20195131 0.74 ALDH1A1 (0.44) MEN1MAPTKMT2ASMN1; SMN2LMNA

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
EP-3327004-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND FUJIFILM CORP (JP) 2020-11-04 EP disclosed
EP-3327004-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND Fujifilm Corporation (JP) 2018-05-30 EP disclosed