SCHEMBL14468747

SCHEMBL14468747

Cc1c(N=Nc2cc(Nc3nc(Cl)nc(Cl)n3)c(S(=O)(=O)O)cc2S(=O)(=O)O)c(O)[nH]c(=O)c1C(N)=O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.37
▸ BTK Q06187 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ HPGDS O60760 1/20 0.32
▸ CARM1 Q86X55 1/20 0.31
▸ PRMT1 Q99873 1/20 0.31
▸ CHAT P28329 2/20 0.31
▸ USP2 O75604 1/20 0.31
▸ APEX1 P27695 1/20 0.31
▸ ENPP3 O14638 1/20 0.30
▸ ENPP1 P22413 1/20 0.30

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
SCHEMBL38654920 0.82 FUT8 (0.35) FUT8ALDH1A1CYP1A2HPGDS
SCHEMBL12173125 0.82 FUT8 (0.35) FUT8ALDH1A1CYP1A2HPGDS
SCHEMBL14468752 0.77 — —
SCHEMBL12974319 0.73 FUT8 (0.33) FUT8
SCHEMBL29404819 0.73 CARM1 (0.35) FUT8CARM1PRMT1USP2APEX1
SCHEMBL12173082 0.73 FUT8 (0.38) FUT8HPGDSCARM1PRMT1CHAT
SCHEMBL12646575 0.73 FUT8 (0.38) FUT8HPGDSCARM1PRMT1CHAT
SCHEMBL14367149 0.72 FUT8 (0.33) FUT8
SCHEMBL14495144 0.71 FUT8 (0.35) FUT8HPGDSCHATUSP2APEX1
SCHEMBL16373350 0.69 CARM1 (0.35) FUT8ALDH1A1CYP1A2HPGDSCARM1

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-2007077129-A2 REACTIVE DYES, A PROCESS FOR THEIR PREPARATION AND THEIR USE HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2007-07-12 — — WO disclosed
Send feedback