SCHEMBL8932545

SCHEMBL8932545

CC(C)(C)[Si](C)(C)OCC(O)CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
MAPK1 P28482 1/20 0.54
RAB9A P51151 1/20 0.52
ALDH1A1 P00352 6/20 0.47
MAPT P10636 3/20 0.44
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
MEN1 O00255 1/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
RXFP1 Q9HBX9 1/20 0.39
RECQL P46063 1/20 0.38

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
SCHEMBL4711900 0.87 KMT2A (0.48) KMT2AMAPK1RAB9AALDH1A1MAPT
SCHEMBL752241 0.85 MMP2 (0.43) KMT2ARAB9AALDH1A1MAPTMEN1
SCHEMBL4320013 0.82 MAPK1 (0.40) KMT2AMAPK1RAB9AALDH1A1MAPT
SCHEMBL31605825 0.79 KMT2A (0.40) KMT2AMAPK1RAB9AALDH1A1MAPT
SCHEMBL772374 0.78 KMT2A (0.69) KMT2AMAPK1RAB9AALDH1A1MAPT
SCHEMBL17595505 0.76 MAPK1 (0.59) KMT2AMAPK1RAB9AALDH1A1MAPT
SCHEMBL24325729 0.76 ALDH1A1 (0.59) KMT2AMAPK1RAB9AALDH1A1MAPT
SCHEMBL12903756 0.76 HPGD (0.51) KMT2AMAPK1RAB9AALDH1A1MAPT
SCHEMBL14948534 0.76 MAPK1 (0.69) KMT2AMAPK1RAB9AALDH1A1MAPT
SCHEMBL27129497 0.76 ALDH1A1 (0.59) KMT2AMAPK1RAB9AALDH1A1MAPT

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
WO-1996026939-A1 CARBAPENEM COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-09-06 WO disclosed