SCHEMBL20107559

SCHEMBL20107559

Nc1cc(N)cc(C(=O)Oc2ccc(N3C(=O)C=CC3=O)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
MGLL Q99685 10/20 0.46
DDAH1 O94760 1/20 0.46
HSP90AA1 P07900 4/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 3/20 0.46
HTT P42858 3/20 0.46
NPSR1 Q6W5P4 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
FAAH O00519 3/20 0.44
PKM P14618 2/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 1/20 0.43
CCR6 P51684 1/20 0.43
ATM Q13315 1/20 0.43
MAPK1 P28482 1/20 0.42
MAPT P10636 1/20 0.39
NSD2 O96028 1/20 0.39

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
SCHEMBL13839733 0.87 HSP90AA1 (0.54) KMT2AMGLLDDAH1HSP90AA1ALDH1A1
SCHEMBL12268600 0.84 HSP90AA1 (0.61) KMT2AMGLLDDAH1HSP90AA1ALDH1A1
SCHEMBL20938446 0.84 HSP90AA1 (0.61) KMT2AMGLLDDAH1HSP90AA1ALDH1A1
SCHEMBL12599305 0.84 MGLL (0.51) KMT2AMGLLDDAH1HSP90AA1ALDH1A1
SCHEMBL6128553 0.83 KMT2A (0.45) KMT2AALDH1A1HPGDHTTCACNA1B
SCHEMBL12599308 0.82 NSD2 (0.58) KMT2AMGLLDDAH1HSP90AA1ALDH1A1
SCHEMBL20348502 0.82 PRSS1 (0.50) KMT2AALDH1A1TDP1PKMLMNA
SCHEMBL20938433 0.80 HSP90AA1 (0.56) KMT2AMGLLDDAH1HSP90AA1ALDH1A1
SCHEMBL20989702 0.80 HSP90AA1 (0.56) KMT2AMGLLDDAH1HSP90AA1ALDH1A1
SCHEMBL11382345 0.80 KMT2A (0.70) KMT2AMGLLDDAH1HSP90AA1ALDH1A1

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
US-20210355279-A1 Polyimides FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. 2021-11-18 US disclosed
US-20200262978-A1 Polyimides FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. 2020-08-20 US disclosed
WO-2018080870-A1 POLYIMIDES FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2018-05-03 WO disclosed