SCHEMBL11477162

SCHEMBL11477162

N#Cc1ccc(OCC(COc2cccc3oc(C#N)cc(=O)c23)OC=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.40
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HIF1A Q16665 1/20 0.39
AR P10275 2/20 0.36
MMP2 P08253 2/20 0.34
ABCC1 P33527 1/20 0.34
ABCG2 Q9UNQ0 1/20 0.34
NMT2 O60551 1/20 0.33
NMT1 P30419 1/20 0.33
MAOB P27338 4/20 0.32
MAOA P21397 2/20 0.32
MMP3 P08254 1/20 0.32
HPGD P15428 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
TNKS O95271 1/20 0.32
PRKDC P78527 2/20 0.32

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
SCHEMBL11482479 0.74 GPR35 (0.57) GPR35LMNATDP1MEN1KMT2A
SCHEMBL6956209 0.73 HPGD (0.55) GPR35LMNATDP1MEN1KMT2A
SCHEMBL11348725 0.73 GPR35 (0.78) GPR35LMNATDP1MEN1KMT2A
SCHEMBL6962937 0.72 HPGD (0.44) GPR35LMNATDP1MEN1KMT2A
SCHEMBL11478258 0.72 GPR35 (0.76) GPR35LMNATDP1MEN1KMT2A
SCHEMBL11478244 0.71 GPR35 (0.78) GPR35LMNATDP1MEN1KMT2A
SCHEMBL6957551 0.69 HPGD (0.43) GPR35LMNATDP1MEN1KMT2A
SCHEMBL11478579 0.69 GPR35 (0.59) GPR35LMNATDP1MEN1KMT2A
SCHEMBL6961672 0.69 ALDH1A1 (0.58) LMNATDP1MEN1KMT2AAR
Cromitrile Sodium SCHEMBL1649767 0.69 GPR35 (0.46) GPR35LMNATDP1MEN1KMT2A

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
US-4238495-A ANTIALLERGENS; ANTIINFLAMMATORY AGENTS MILES LABORATORIES, INC. (US) 1980-12-09 US disclosed