SCHEMBL4949052

SCHEMBL4949052

CC1(C)C2C=CC1(CC1=CCCCC1=O)C(=O)C2

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 2/20 0.35
MAPT P10636 2/20 0.31
CYP19A1 P11511 1/20 0.30

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
SCHEMBL4947121 0.73
SCHEMBL13743414 0.63
SCHEMBL743966 0.63
SCHEMBL4270155 0.62 GSTP1 (0.37) GSTP1MAPT
SCHEMBL1237584 0.60 GSTP1 (0.46) GSTP1MAPT
SCHEMBL2331802 0.60
SCHEMBL3132479 0.60
SCHEMBL10684955 0.60
SCHEMBL11211634 0.59 GSTP1 (0.45) GSTP1MAPT
SCHEMBL27439058 0.59 GSTP1 (0.57) GSTP1MAPT

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
JP-2008127333-A MANUFACTURING METHOD OF CAMPHORENYLCYCLOHEXENOL COMPOUND KAO CORP 2008-06-05 JP disclosed