SCHEMBL29280771

SCHEMBL29280771

CC(C)c1cc(-c2ccc(O)c(C(C)C)c2O)cc(C(C)C)c1C(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
GABRA1 P14867 6/20 0.39
GABRB2 P47870 4/20 0.39
GABRB1 P18505 4/20 0.38
LMNA P02545 2/20 0.36
SLC6A2 P23975 2/20 0.36
HTR2B P41595 2/20 0.36
HIF1A Q16665 2/20 0.36
FAAH O00519 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
GABRG2 P18507 1/20 0.36
PTGS1 P23219 1/20 0.36
HTR2C P28335 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36

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
SCHEMBL27601367 0.78 BACE1 (0.45) GABRA1GABRB2CYP3A4HPGDABCB1
SCHEMBL6679675 0.74 GABRA1 (0.52) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL4395181 0.72 CA1 (0.54) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL13773184 0.71 RNASEH1 (0.45) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL16527874 0.70 LMNA (0.45) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL6302922 0.69 CA1 (0.70) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL30360391 0.68 TYR (0.44) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL1760433 0.68 TYR (0.44) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL1885197 0.68 CA1 (0.41) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL6676697 0.68 CA1 (0.41) CA1CA2GABRA1GABRB2GABRB1

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-117813493-A Sensitive membrane and gas sensor 松下知识产权经营株式会社 2024-04-02 CN disclosed