SCHEMBL26849070

SCHEMBL26849070

CCOC(=O)c1cc(=O)c2c(OCC(COc3cccc4oc(C(=O)OCC)cc(=O)c34)OCOC(C)=O)cccc2o1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR35 Q9HC97 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ ADRB2 P07550 4/20 0.44
▸ NMT2 O60551 3/20 0.44
▸ ADRB1 P08588 3/20 0.44
▸ ADRB3 P13945 3/20 0.44
▸ NMT1 P30419 3/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ USP2 O75604 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ AKR1B1 P15121 1/20 0.43
▸ MAOB P27338 2/20 0.43

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
SCHEMBL26848984 0.89 GPR35 (0.55) GPR35LMNATDP1MEN1KMT2A
SCHEMBL26848868 0.89 GPR35 (0.67) GPR35LMNATDP1MEN1KMT2A
SCHEMBL21556417 0.86 GPR35 (0.52) GPR35LMNATDP1MEN1KMT2A
SCHEMBL26848987 0.85 GPR35 (0.55) GPR35LMNATDP1MEN1KMT2A
SCHEMBL143979 0.84 GPR35 (0.72) GPR35LMNATDP1MEN1KMT2A
SCHEMBL26848983 0.84 GPR35 (0.54) GPR35LMNATDP1MEN1KMT2A
SCHEMBL26848985 0.84 GPR35 (0.54) GPR35LMNATDP1MEN1KMT2A
SCHEMBL15731816 0.83 GPR35 (0.49) GPR35LMNATDP1MEN1KMT2A
SCHEMBL26848867 0.83 GPR35 (0.68) GPR35LMNATDP1MEN1KMT2A
SCHEMBL144592 0.83 GPR35 (0.58) 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
WO-2023230418-A1 MUTUAL PRODRUGS OF CROMOGLICIC ACID SAMDOLITE PHARMACEUTICALS LLC (US) 2023-11-30 — — WO disclosed
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