SCHEMBL11304528

SCHEMBL11304528

CC(C)(C)NC(=O)Cc1ccc(OC(=O)c2ccc(NC(=N)N)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
MAPK1 P28482 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
PRSS1 P07477 3/20 0.44
ACR P10323 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
LMNA P02545 1/20 0.43
KLK1 P06870 2/20 0.43
TMPRSS15 P98073 4/20 0.43
TMPRSS2 O15393 1/20 0.43
GAA P10253 1/20 0.43
PDE4B Q07343 1/20 0.40

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
SCHEMBL11308016 0.87 KMT2A (0.47) KMT2AMEN1MAPK1ALDH1A1MAPT
SCHEMBL11313197 0.85 KMT2A (0.48) KMT2AMEN1MAPK1ALDH1A1MAPT
SCHEMBL11313369 0.85 TMPRSS15 (0.47) KMT2AMEN1MAPK1ALDH1A1MAPT
SCHEMBL11302255 0.84 LMNA (0.52) KMT2AMEN1MAPTPRSS1ACR
SCHEMBL26047455 0.84 KMT2A (0.52) KMT2AMEN1MAPK1ALDH1A1MAPT
SCHEMBL11313907 0.84 PRSS1 (0.49) KMT2AMEN1MAPK1ALDH1A1PRSS1
SCHEMBL20008699 0.83 KMT2A (0.48) KMT2AMEN1ALDH1A1PRSS1ACR
SCHEMBL18720203 0.83 KMT2A (0.48) KMT2AMEN1ALDH1A1PRSS1ACR
SCHEMBL11410222 0.83 SMN1; SMN2 (0.50) KMT2AMEN1MAPK1ALDH1A1MAPT
SCHEMBL11306080 0.83 KMT2A (0.46) KMT2AMEN1MAPK1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4283418-A ANTIPLASMIN AND ANTITRYPSIN AGENTS ONO PHARMACEUTICAL CO., LTD. (JP) 1981-08-11 US disclosed