SCHEMBL8520386

SCHEMBL8520386

CCc1ccc(C2(CC=O)CC2)cc1CC

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.34
RXRG P48443 2/20 0.34
RARA P10276 1/20 0.34
RARB P10826 1/20 0.34
RARG P13631 1/20 0.34
SLC6A4 P31645 6/20 0.32
SLC6A3 Q01959 6/20 0.32
SLC6A2 P23975 1/20 0.32
GAA P10253 1/20 0.31
CASP1 P29466 1/20 0.31

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
SCHEMBL8417706 0.76 SLC6A4 (0.38) SLC6A4SLC6A3SLC6A2CASP1
SCHEMBL7722936 0.73 RXRA (0.67) RXRARXRGRARARARBRARG
SCHEMBL7722935 0.73 RXRA (0.67) RXRARXRGRARARARBRARG
SCHEMBL7996385 0.73 RXRA (0.59) RXRARXRGRARARARBRARG
SCHEMBL10726430 0.71 NQO1 (0.47) SLC6A4SLC6A3SLC6A2
SCHEMBL3406637 0.71 SLC6A4 (0.47) SLC6A4SLC6A3SLC6A2
SCHEMBL1952022 0.70 ALDH1A1 (0.42) SLC6A4SLC6A3
SCHEMBL8443175 0.70 ALDH1A1 (0.41) RARBSLC6A4SLC6A3SLC6A2
SCHEMBL19207570 0.70 MAOA (0.54) SLC6A4SLC6A3SLC6A2
SCHEMBL2443315 0.68 KMT2A (0.38) SLC6A4SLC6A3SLC6A2

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
US-6005007-A SKIN DISORDERS LIGAND PHARMACEUTICALS INCORPORATED 1999-12-21 US disclosed