SCHEMBL9812436

SCHEMBL9812436

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.46
ALOX15 P16050 2/20 0.46
ALOX12 P18054 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HIF1A Q16665 1/20 0.46
GABRA1 P14867 2/20 0.39
GABRB1 P18505 1/20 0.39
PDE2A O00408 1/20 0.38
GABRB2 P47870 1/20 0.36
KIF11 P52732 1/20 0.36
TSHR P16473 3/20 0.36
TTR P02766 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
RECQL P46063 1/20 0.36
LMNA P02545 2/20 0.34
HPGD P15428 2/20 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
SCHEMBL736680 0.87 HSD17B10 (0.61) HSD17B10ALOX15ALOX12CYP1A2CYP2C9
SCHEMBL9812409 0.84 CA1 (0.44) HSD17B10ALOX15CYP1A2HIF1AGABRA1
SCHEMBL2974180 0.81 GABRA1 (0.56) HSD17B10ALOX15ALOX12CYP1A2CYP2C9
SCHEMBL9861534 0.77 GABRA1 (0.38) HSD17B10ALOX15HIF1AGABRA1GABRB1
SCHEMBL8950753 0.75 HSD17B10 (0.43) HSD17B10ALOX15ALOX12CYP1A2CYP2C9
SCHEMBL11340181 0.73 GABRA1 (0.70) HSD17B10ALOX15ALOX12CYP1A2SMN1; SMN2
SCHEMBL8229173 0.73 SMN1; SMN2 (0.37) HSD17B10ALOX15ALOX12CYP1A2CYP2C9
SCHEMBL12529998 0.73 SMN1; SMN2 (0.37) HSD17B10ALOX15ALOX12CYP1A2CYP2C9
SCHEMBL19667832 0.72 PDE2A (0.56) HSD17B10ALOX15SMN1; SMN2HIF1APDE2A
SCHEMBL29290531 0.71 ADRB1 (0.50) HSD17B10ALOX15ALOX12CYP1A2CYP2C9

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