Sugi Predict

Sugi Predict / Compounds / SCHEMBL8568634

SCHEMBL8568634

SCHEMBL8568634

CC(C=CC=C(C)c1cc2c(cc1OCCCCCO)C(C)(C)CCC2(C)C)=CC(=O)O

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 19/20 0.80
▸ RARG P13631 13/20 0.80
▸ RARA P10276 9/20 0.80
▸ RARB P10826 9/20 0.80
▸ RXRB P28702 7/20 0.80
▸ RXRG P48443 7/20 0.80
▸ PPARG P37231 6/20 0.46

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
SCHEMBL8568632 1.00 RXRA (0.80) RXRARARGRARARARBRXRB
SCHEMBL8899800 0.91 RXRA (0.88) RXRARARGRARARARBRXRB
SCHEMBL5175957 0.89 RXRA (1.00) RXRARARGRARARARBRXRB
SCHEMBL502044 0.89 RXRA (1.00) RXRARARGRARARARBRXRB
SCHEMBL502045 0.89 RXRA (1.00) RXRARARGRARARARBRXRB
SCHEMBL502043 0.89 RXRA (1.00) RXRARARGRARARARBRXRB
SCHEMBL7771888 0.86 RXRA (0.70) RXRARARGRARARARBRXRB
SCHEMBL7771885 0.86 RXRA (0.70) RXRARARGRARARARBRXRB
SCHEMBL7771891 0.86 RXRA (0.70) RXRARARGRARARARBRXRB
SCHEMBL11485389 0.84 RXRA (1.00) RXRARARGRARARARBRXRB

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
JP-10101641-A — — None — — JP disclosed
JP-H10101641-A NEW HORMONE RECEPTOR ADJUSTING COMPOUND, COMPOSITION CONTAINING THE SAME AND TREATING USE THEREOF CIRD GALDERMA 1998-04-21 — — JP disclosed