SCHEMBL4628600

SCHEMBL4628600

CN(O)C(=O)Cc1ccc(CC(=O)NC23CC4CC(CC(C4)C2)C3)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
POLB P06746 1/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
EPHX2 P34913 2/20 0.49
LMNA P02545 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL19798449 0.80 KMT2A (0.72) ALDH1A1KMT2AMEN1EPHX2NPC1
SCHEMBL12961980 0.78 EPHX2 (0.62) ALDH1A1POLBMAPTKMT2AMEN1
SCHEMBL4610298 0.77 CNR2 (0.64) ALDH1A1POLBEPHX2SMN1; SMN2
SCHEMBL19798759 0.77 ALDH1A1 (0.68) ALDH1A1POLBMAPTKMT2AMEN1
SCHEMBL1758671 0.73 ALDH1A1 (0.60) ALDH1A1POLBMAPTKMT2AMEN1
SCHEMBL13596196 0.71 NPC1 (0.54) ALDH1A1KMT2AMEN1EPHX2NPC1
SCHEMBL9334741 0.70 TSHR (0.61) ALDH1A1KMT2AMEN1EPHX2NPC1
SCHEMBL19807171 0.70 KMT2A (0.56) ALDH1A1KMT2AMEN1EPHX2NPC1
SCHEMBL13596178 0.70 ADRB2 (0.59) ALDH1A1POLBKMT2AMEN1EPHX2
SCHEMBL6565633 0.69 HTT (0.49) ALDH1A1POLBMAPTKMT2AMEN1

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
EP-1660437-B1 HYDROXAMIC ACID DERIVATIVES AND THE METHOD FOR PREPARING THEREOF AMOREPACIFIC CORP (KR) 2008-10-15 EP claimed