SCHEMBL27316766

SCHEMBL27316766

CCOc1ccc(O)c(OO)c1OO

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.43
▸ TUBB1 Q9H4B7 1/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ ESR1 P03372 1/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ ABCB1 P08183 1/20 0.41
▸ BCR P11274 1/20 0.41
▸ PDE4A P27815 2/20 0.39
▸ PDE4B Q07343 2/20 0.39
▸ PDE4C Q08493 2/20 0.39
▸ PDE4D Q08499 2/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ ALPI P09923 1/20 0.39
▸ ALPG P10696 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ LTA4H P09960 1/20 0.38
▸ TOP2A P11388 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ MAPK1 P28482 1/20 0.38

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
SCHEMBL31332164 0.83 ESR1 (0.47) ALDH1A1TUBB1MEN1KMT2AESR1
SCHEMBL1838297 0.83 ESR1 (0.47) ALDH1A1TUBB1MEN1KMT2AESR1
SCHEMBL5588485 0.78 ESR1 (0.46) ALDH1A1TUBB1MEN1KMT2AESR1
SCHEMBL28960718 0.77 ALDH1A1 (0.41) ALDH1A1TUBB1MEN1KMT2AESR1
SCHEMBL11131743 0.75 NQO1 (0.46) ALDH1A1TUBB1MEN1KMT2AESR1
SCHEMBL12476303 0.75 ESR1 (0.47) ALDH1A1TUBB1MEN1KMT2AESR1
SCHEMBL11877773 0.74 TUBB1 (0.45) ALDH1A1TUBB1MEN1KMT2AESR1
SCHEMBL34475986 0.73 ALDH1A1 (0.45) ALDH1A1TUBB1MEN1KMT2AL3MBTL1
SCHEMBL1835919 0.73 ALDH1A1 (0.45) ALDH1A1TUBB1MEN1KMT2AL3MBTL1
SCHEMBL9196941 0.73 ALDH1A1 (0.48) ALDH1A1TUBB1MEN1KMT2AL3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1029999-C Reduction of terminal carboxyl groups in polyesters with lactim ethers ALLIED SIGNAL INC (US) 1995-10-11 — — CN disclosed
CN-1035534-A Reduce terminal carboxyl group in the polyester with the lactim ethers ALLIED SIGNAL INC (US) 1989-09-13 — — CN disclosed
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