SCHEMBL7940148

SCHEMBL7940148

Cc1ccc(OCc2ccc(B(O)O)cc2C)c(C2CSC(N3CCC(C(=O)O)CC3)=N2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 2/20 0.35
PTGDR2 Q9Y5Y4 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HSD17B10 Q99714 2/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
FFAR1 O14842 1/20 0.32
NOTUM Q6P988 1/20 0.32
USP2 O75604 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GUCY1B2 O75343 2/20 0.31
GUCY1A2 P33402 2/20 0.31
GUCY1A1 Q02108 2/20 0.31
GUCY1B1 Q02153 2/20 0.31
TP53 P04637 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NEK2 P51955 1/20 0.31

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
SCHEMBL7940603 0.81 CD274 (0.35) CD274NOTUM
SCHEMBL7941017 0.81 MAPK1 (0.47) KDM4EHSD17B10TSHRHPGDTP53
SCHEMBL7944082 0.81 NEK2 (0.36) CD274PTGDR2NEK2
SCHEMBL7934714 0.77 MAPT (0.36) SMN1; SMN2
SCHEMBL3230736 0.77 GUCY1B2 (0.50) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL7939410 0.75 ALDH1A1 (0.38) KDM4EHSD17B10GAATSHRCASP1
SCHEMBL7944340 0.73 MAPT (0.36) KDM4ETP53SMN1; SMN2CCR5
SCHEMBL19110961 0.68 GUCY1B2 (0.54) GUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL7940050 0.66 KDM5A (0.35) CD274
SCHEMBL3229753 0.63 GUCY1B2 (0.47) GUCY1B2GUCY1A2GUCY1A1GUCY1B1

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
WO-2010015652-A2 THIAZOLE COMPOUNDS AS ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE SMITHKLINE BEECHAM CORPORATION (US) 2010-02-11 WO disclosed