SCHEMBL30023071

SCHEMBL30023071

Cc1cc(C(=O)O)c2c(-c3ccc(OCc4ccccc4)cc3)c(-c3ccc(OCc4ccccc4)cc3)oc2c1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.51
▸ ANO1 Q5XXA6 7/20 0.49
▸ MCL1 Q07820 1/20 0.49
▸ SLC16A3 O15427 1/20 0.46
▸ MAOB P27338 1/20 0.45
▸ TSPO P30536 1/20 0.45
▸ PTGER4 P35408 2/20 0.45

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
SCHEMBL28654975 0.85 MAPT (0.53) ANO1MCL1SLC16A3PTGER4
SCHEMBL28668413 0.84 MEN1 (0.47) DHODHMAOB
SCHEMBL30022887 0.83 ALDH1A1 (0.50) —
SCHEMBL30022919 0.79 PTPN22 (0.50) DHODHPTGER4
SCHEMBL28655615 0.78 DHODH (0.53) DHODHMCL1SLC16A3MAOBTSPO
SCHEMBL28680766 0.78 KDM4E (0.45) ANO1
SCHEMBL30023247 0.78 KDM4E (0.45) ANO1
SCHEMBL30023283 0.78 KDM4E (0.45) ANO1
SCHEMBL30023487 0.78 DHODH (0.45) DHODHANO1
SCHEMBL30022975 0.78 PTGS2 (0.41) ANO1

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
CN-113754619-B Method for preparing polysubstituted benzofuran-4-formic acid compound under catalysis of ruthenium 广州大学 2022-12-20 — — CN disclosed
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