SCHEMBL4654199

SCHEMBL4654199

CCC(C)[C](C1CC1)C1CC1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 1/20 0.33
SHBG P04278 1/20 0.32
EPHX2 P34913 2/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 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
SCHEMBL4654430 0.90 SHBG (0.37) TSHRSHBGEPHX2CHRNB4CHRNA3
SCHEMBL12838113 0.74
SCHEMBL19012246 0.74
SCHEMBL24221648 0.74 NPSR1 (0.37) NPSR1EPHX2CHRNB4CHRNA3
SCHEMBL805266 0.74
SCHEMBL4653050 0.69
SCHEMBL18494027 0.69 NPSR1 (0.34) NPSR1EPHX2CHRNB4CHRNA3
SCHEMBL3787105 0.67 POLB (0.38) TSHR
SCHEMBL22313529 0.66 SMYD3 (0.40) NPSR1EPHX2CHRNB4CHRNA3
SCHEMBL11126037 0.65 SHBG (0.39) SHBGEPHX2

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-1986598-A1 UV FILTER CAPSULES COMPRISING AN AMINOSUBSTITUTED HYDROXYBENZOPHENONE Merck Patent GmbH (DE) 2008-11-05 EP disclosed
WO-2007093252-A1 UV FILTER CAPSULES COMPRISING AN AMINOSUBSTITUTED HYDROXYBENZOPHENONE MERCK PATENT GMBH (DE) 2007-08-23 WO disclosed