SCHEMBL31475474

SCHEMBL31475474

Cc1cc(CC(=O)O)n(C2CCCCO2)n1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.49
RXRB P28702 1/20 0.49
RXRG P48443 1/20 0.49
CYP4F2 P78329 3/20 0.40
CYP4A11 Q02928 3/20 0.40
GAA P10253 1/20 0.39
KCNJ3 P48549 8/20 0.37
KCNJ6 P48051 7/20 0.37
KCNJ5 P48544 5/20 0.37
ALDH1A1 P00352 2/20 0.37
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
LMNA P02545 1/20 0.34
POLQ O75417 1/20 0.34
HTT P42858 1/20 0.33

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
SCHEMBL24103620 0.83 GAA (0.43) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL30705605 0.81 RXRA (0.47) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL5808161 0.81 KCNJ3 (0.50) KCNJ3KCNJ6KCNJ5
SCHEMBL29027958 0.79 GAA (0.39) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL30705556 0.78 RXRA (0.35) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL14726450 0.77 GAA (0.47) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL20516874 0.77 RXRA (0.52) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL21187505 0.75 GAA (0.43) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL17377535 0.75 GAA (0.44) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL19641656 0.75 GAA (0.44) RXRARXRBRXRGCYP4F2CYP4A11

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
CN-119604290-A Compounds for the treatment of coronavirus infections 特劳斯芬尼德治疗股份有限公司 2025-03-11 CN disclosed