SCHEMBL6567242

SCHEMBL6567242

Cc1ccc(NC(=O)NC23CC4CC(CC(C4)C2)C3)c(O)c1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 15/20 0.67
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
CXCR2 P25025 1/20 0.51

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
SCHEMBL4357793 0.86 EPHX2 (0.70) EPHX2
SCHEMBL6565549 0.80 EPHX2 (1.00) EPHX2MAPTNPSR1
SCHEMBL25684474 0.79 EPHX2 (0.84) EPHX2LMNA
SCHEMBL6566257 0.76 EPHX2 (0.71) EPHX2MAPTNPSR1
SCHEMBL4354504 0.76 EPHX2 (0.67) EPHX2MAPTNPSR1
SCHEMBL4350925 0.73 EPHX2 (0.67) EPHX2MAPTNPSR1
SCHEMBL12932207 0.73 MAPT (0.68) EPHX2MAPTNPSR1
SCHEMBL6568669 0.73 EPHX2 (0.80) EPHX2
SCHEMBL4348756 0.73 NPSR1 (0.55) EPHX2LMNAMAPTNPSR1
SCHEMBL18423981 0.72 EPHX2 (1.00) EPHX2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1402887-A1 New compounds for the inhibition of undesired cell proliferation and use thereof Jerini AG (DE) 2004-03-31 EP claimed
EP-1402888-A1 The use of substituted carbocyclic compounds as rotamases inhibitors Jerini AG (DE) 2004-03-31 EP claimed