SCHEMBL7754078

SCHEMBL7754078

CCCc1[c]ccc(C2CCCC2)c1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.40
CTSK P43235 6/20 0.38
CTSS P25774 5/20 0.38
DRD2 P14416 5/20 0.37
DRD1 P21728 1/20 0.37
DRD4 P21917 1/20 0.37
DRD5 P21918 1/20 0.37
DRD3 P35462 1/20 0.37
ACMSD Q8TDX5 2/20 0.35
KMO O15229 1/20 0.35
SLC6A4 P31645 1/20 0.34

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
SCHEMBL458578 0.80 DRD2 (0.35) DRD2SLC6A4
SCHEMBL9013264 0.78 DRD2 (0.31) DRD2SLC6A4
SCHEMBL11270086 0.73 HDAC4 (0.37) EPHX2ACMSDKMOSLC6A4
SCHEMBL27748636 0.73 PRMT5 (0.33)
SCHEMBL29026546 0.73 ESR2 (0.36) DRD2ACMSDKMO
SCHEMBL6568489 0.72 KMO (0.39) EPHX2ACMSDKMO
SCHEMBL29125236 0.72 KMO (0.39) EPHX2ACMSDKMO
SCHEMBL28299092 0.71 HDAC8 (0.38) EPHX2ACMSDKMOSLC6A4
SCHEMBL16953245 0.70 SPHK1 (0.38) DRD2SLC6A4
SCHEMBL1778645 0.69 KMO (0.40) EPHX2ACMSDKMOSLC6A4

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-1071660-A1 N-SULPHONYL AND N-SULPHINYL PHENYLGLYCINAMIDE Novartis AG (CH) 2001-01-31 EP disclosed
WO-1999043644-A1 N-SULPHONYL AND N-SULPHINYL PHENYLGLYCINAMIDE___________________ NOVARTIS AG (CH) 1999-09-02 WO disclosed