SCHEMBL6424355

SCHEMBL6424355

CC(C)(C)OC(=O)NC1CCC(N(CCc2ccccc2)C(=O)O)CC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KDM1A O60341 1/20 0.50
MAOB P27338 1/20 0.50
KCNA3 P22001 1/20 0.47
REN P00797 1/20 0.46
DRD2 P14416 3/20 0.45
SMYD3 Q9H7B4 3/20 0.43
AKT1 P31749 2/20 0.43
OPRM1 P35372 2/20 0.42
PKM P14618 1/20 0.42
EPHX2 P34913 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 1/20 0.41
TSHR P16473 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
SCHEMBL31520824 0.83 KDM1A (0.57) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL6863653 0.83 KDM1A (0.57) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL21071384 0.83 KDM1A (0.57) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL1813191 0.83 KMT2A (0.55) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL3206908 0.82 KMT2A (0.54) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL3206911 0.82 KMT2A (0.54) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL25033862 0.81 KMT2A (0.53) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL25382352 0.81 ALDH1A1 (0.53) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL4266530 0.79 KMT2A (0.58) KMT2AL3MBTL1KDM1AMAOBKCNA3
SCHEMBL5694937 0.79 KMT2A (0.58) KMT2AL3MBTL1KDM1AMAOBKCNA3

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-1286673-B1 LIGANDS OF INTEGRIN RECEPTORS BASF AG (DE) 2005-05-25 EP disclosed