SCHEMBL9812409

SCHEMBL9812409

CC(O)c1cc(C(C)O)c(O)c(C(C)O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
GABRA1 P14867 5/20 0.43
GABRB2 P47870 3/20 0.43
GABRB1 P18505 4/20 0.41
LMNA P02545 3/20 0.39
TSHR P16473 2/20 0.39
BLM P54132 2/20 0.39
HIF1A Q16665 2/20 0.39
HTR2B P41595 2/20 0.39
FAAH O00519 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
GABRG2 P18507 1/20 0.39
PTGS1 P23219 1/20 0.39
SLC6A2 P23975 1/20 0.39
HTR2C P28335 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA5 P31644 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
SCHEMBL9861534 0.86 GABRA1 (0.38) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL9812436 0.84 HSD17B10 (0.46) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL9614164 0.79 CA2 (0.44) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL11340181 0.77 GABRA1 (0.70) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL9334010 0.76 UGT2B7 (0.46) LMNATSHRBLMHIF1AUGT2B7
SCHEMBL9331671 0.76 UGT2B7 (0.46) LMNATSHRBLMHIF1AUGT2B7
SCHEMBL9331613 0.76 UGT2B7 (0.46) LMNATSHRBLMHIF1AUGT2B7
SCHEMBL2990688 0.76 GABRA1 (0.50) GABRA1GABRB2LMNATSHRBLM
SCHEMBL22991571 0.74 TTR (0.50) CA1CA2GABRA1GABRB2GABRB1
SCHEMBL22991576 0.74 CA1 (0.50) CA1CA2GABRA1GABRB2LMNA

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-0234305-B1 METHOD FOR THE PRESERVATION OF WOOD Cooke, Theodore F. Jr. (US) 1991-07-03 EP claimed
EP-0234305-B1 METHOD FOR THE PRESERVATION OF WOOD Cooke, Theodore F. Jr. (US) 1991-07-03 EP disclosed
EP-0234305-A1 Method for the preservation of wood Cooke, Theodore F. Jr. (US) 1987-09-02 EP disclosed
US-4661382-A TREATMENT WITH ALKYLOL GROUP CONTAINING PHENOL COOKE THEODORE F JR 1987-04-28 US disclosed