SCHEMBL24199932

SCHEMBL24199932

CCOC(=O)Cc1ccc(-c2ccccc2)cc1OC(C)/C=C\C(Br)=C(/C)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ TRPM8 Q7Z2W7 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ AHR P35869 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PRMT5 O14744 1/20 0.34
▸ ESR1 P03372 1/20 0.34
▸ PKM P14618 2/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PPARA Q07869 1/20 0.33
▸ DHODH Q02127 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ NFKB1 P19838 1/20 0.33

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
SCHEMBL24200130 0.88 TBXAS1 (0.39) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL24199930 0.80 CFD (0.35) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL24200119 0.78 MEN1 (0.33) ALDH1A1MAPTL3MBTL1HPGDTDP1
SCHEMBL25913045 0.75 L3MBTL1 (0.49) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL21438503 0.75 RECQL (0.46) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL21455980 0.73 ALDH1A1 (0.36) ALDH1A1MAPTL3MBTL1SMN1; SMN2MEN1
SCHEMBL24200170 0.73 TBXAS1 (0.42) ALDH1A1MAPTL3MBTL1HPGDSMN1; SMN2
SCHEMBL6862344 0.72 L3MBTL1 (0.49) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL11836751 0.72 L3MBTL1 (0.43) KDM4EALDH1A1MAPTL3MBTL1HPGD
SCHEMBL21455422 0.71 KMT2A (0.34) KDM4EALDH1A1MAPTL3MBTL1HPGD

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
EP-3939658-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS Biocryst Pharmaceuticals, Inc. (US) 2022-01-19 — — EP disclosed
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