SCHEMBL6446470

SCHEMBL6446470

CC(C)c1ccccc1OC(O)CO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
GABRA1 P14867 3/20 0.42
GABRG2 P18507 2/20 0.42
GABRB3 P28472 2/20 0.42
NISCH Q9Y2I1 2/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
GABRB2 P47870 2/20 0.41
ADRB2 P07550 2/20 0.40
ADRB1 P08588 2/20 0.40
ADRB3 P13945 2/20 0.40
CYP1A2 P05177 4/20 0.39
CYP3A4 P08684 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL4293432 0.80 GABRA1 (0.46) LMNAALDH1A1KMT2AMEN1GABRA1
SCHEMBL7120232 0.77 CYP1A2 (0.58) LMNAALDH1A1KMT2AMEN1ADRA2B
SCHEMBL8245039 0.76 NISCH (0.49) LMNAALDH1A1KMT2AMEN1GABRA1
SCHEMBL15999373 0.75 CYP1A2 (0.65) LMNAALDH1A1KMT2AMEN1ADRB2
SCHEMBL12040803 0.75 CYP1A2 (0.65) LMNAALDH1A1KMT2AMEN1ADRB2
SCHEMBL15999372 0.75 CYP1A2 (0.65) LMNAALDH1A1KMT2AMEN1ADRB2
Hydrogen Sulfide SCHEMBL27992927 0.74 NISCH (0.47) LMNAALDH1A1KMT2AMEN1GABRA1
SCHEMBL23623700 0.73 CYP1A2 (0.39) LMNAKMT2AMEN1CYP1A2CYP2C19
SCHEMBL13533202 0.73 MCHR1 (0.45) LMNAALDH1A1KMT2AMEN1GABRA1
SCHEMBL16116482 0.73 LMNA (0.50) LMNAALDH1A1KMT2AMEN1GABRA1

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-6956072-B1 Thermoplastic resin composition and molded object thereof POLYPLASTICS CO., LTD. (JP) 2005-10-18 US disclosed