SCHEMBL5384568

SCHEMBL5384568

N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1cccc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.63
KMT2A Q03164 3/20 0.63
MEN1 O00255 2/20 0.63
LMNA P02545 2/20 0.63
KDM4E B2RXH2 1/20 0.61
MPO P05164 1/20 0.61
TSHR P16473 1/20 0.61
BLM P54132 1/20 0.61
PMP22 Q01453 1/20 0.61
HIF1A Q16665 1/20 0.61
HDAC3 O15379 3/20 0.56
HDAC1 Q13547 3/20 0.56
HDAC8 Q9BY41 3/20 0.56
HDAC6 Q9UBN7 3/20 0.56
HDAC4 P56524 2/20 0.56
HDAC7 Q8WUI4 2/20 0.56
HDAC2 Q92769 2/20 0.56
HDAC10 Q969S8 2/20 0.56
HDAC11 Q96DB2 2/20 0.56
HDAC9 Q9UKV0 2/20 0.56

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
Hydrochloric Acid SCHEMBL19747609 0.90 KMT2A (0.67) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL15142972 0.88 KMT2A (0.64) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL15142954 0.83 KDM4E (0.64) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL15142948 0.83 KDM4E (0.64) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL8690475 0.83 MAPT (0.66) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL8690481 0.83 MAPT (0.66) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL15145370 0.83 KMT2A (0.57) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL9609465 0.83 MEN1 (0.71) MAPTKMT2AMEN1LMNAKDM4E
Hydrochloric Acid SCHEMBL19748758 0.83 RUVBL1 (0.73) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL30767397 0.83 MEN1 (0.71) MAPTKMT2AMEN1LMNAKDM4E

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-7163671-B2 Long-term stabilized formulations CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-01-16 US disclosed
US-20030092622-A1 Preparation stabilized over long time CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-05-15 US disclosed
EP-1260230-A1 PREPARATIONS STABILIZED OVER LONG TIME CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-11-27 EP disclosed