SCHEMBL9861386

SCHEMBL9861386

Cc1ccc(C(C)O)c(O)c1C(C)O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
PTGS1 P23219 2/20 0.33
SLC6A2 P23975 2/20 0.33
HTR2B P41595 2/20 0.33
TRPA1 O75762 2/20 0.33
FAAH O00519 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
GABRA1 P14867 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
HTR2C P28335 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 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
SCHEMBL9862038 0.83 ALDH1A1 (0.37) LMNAPTGS1SLC6A2HTR2BTRPA1
SCHEMBL3918723 0.80 ADRB2 (0.36) LMNAPTGS1SLC6A2HTR2BTRPA1
SCHEMBL30411767 0.76 GABRA1 (0.50) LMNAPTGS1SLC6A2HTR2BTRPA1
SCHEMBL1487336 0.76 GABRA1 (0.50) LMNAPTGS1SLC6A2HTR2BTRPA1
SCHEMBL14600343 0.76 ALDH1A1 (0.39) LMNAPTGS1SLC6A2HTR2BTRPA1
SCHEMBL8980659 0.75 NNMT (0.38) LMNAHPGDTSHRALDH1A1GRM1
Potassium SCHEMBL30893108 0.74 GABRA1 (0.48) LMNAPTGS1SLC6A2HTR2BTRPA1
SCHEMBL29477985 0.74 GABRA1 (0.48) LMNAPTGS1SLC6A2HTR2BTRPA1
SCHEMBL6397577 0.73 TRPA1 (0.40) LMNAPTGS1SLC6A2TRPA1CYP1A2
SCHEMBL24217828 0.70 ADRB2 (0.42) LMNAPTGS1SLC6A2HTR2BTRPA1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0032062-B2 HIGH-MOLECULAR-WEIGHT NOVOLAK SUBSTITUTED PHENOLIC RESINS AND THEIR PREPARATION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-10-16 EP disclosed
EP-0032062-B1 HIGH-MOLECULAR-WEIGHT NOVOLAK SUBSTITUTED PHENOLIC RESINS AND THEIR PREPARATION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1985-04-03 EP disclosed
US-4345054-A High-molecular-weight novolak types substituted phenolic resins and process for preparation thereof MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1982-08-17 US disclosed
EP-0032062-A2 High-molecular-weight novolak substituted phenolic resins and their preparation MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1981-07-15 EP disclosed