SCHEMBL8842991

SCHEMBL8842991

CC(CCC(N)=O)CNCc1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
HPGD P15428 2/20 0.46
TSHR P16473 1/20 0.44
DPP4 P27487 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
NPC1 O15118 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
FOLH1 Q04609 1/20 0.40
HTT P42858 1/20 0.40
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 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
SCHEMBL8843322 0.85 ANPEP (0.48) HDAC3HDAC1HDAC2HDAC8L3MBTL1
SCHEMBL8843418 0.76 KDM4E (0.58) HPGDTSHRKDM4EALDH1A1MEN1
SCHEMBL172622 0.75 LMNA (0.63) LMNAHPGDNPC1L3MBTL1MAPK1
SCHEMBL27581999 0.74 LMNA (0.53) LMNAHPGDTSHRNPC1L3MBTL1
SCHEMBL27599234 0.74 LMNA (0.53) LMNAHPGDTSHRNPC1L3MBTL1
SCHEMBL5798369 0.74 MAPT (0.54) LMNAHPGDNPC1KDM4EALDH1A1
SCHEMBL13330952 0.73 LMNA (0.60) LMNAHPGDNPC1L3MBTL1MAPK1
SCHEMBL3705685 0.73 SCN3A (0.55) LMNADPP4HDAC3HDAC1HDAC2
SCHEMBL8843532 0.73 FOLH1 (0.49) HDAC3HDAC1HDAC2HDAC8L3MBTL1
SCHEMBL2247510 0.72 FOLH1 (0.49) LMNAMAPK1ALDH1A1FOLH1HTT

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-5672615-A MATRIX-DEGRADING METALLOPROTEINASE INHIBITORS NOVARTIS CORPORATION (US) 1997-09-30 US disclosed