SCHEMBL10494242

SCHEMBL10494242

COc1c(OC)c(OC)c2c(c1OC)C(=O)C=C(O)C2=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 3/20 0.37
▸ EPHX2 P34913 1/20 0.35
▸ MAPT P10636 5/20 0.33
▸ KDM4E B2RXH2 4/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ USP2 O75604 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ POLB P06746 3/20 0.33
▸ RECQL P46063 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ TXNRD1 Q16881 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PIM1 P11309 1/20 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
SCHEMBL5820817 0.82 PIM1 (0.41) XIAPEPHX2MAPTKDM4EALDH1A1
SCHEMBL10494234 0.80 MAPT (0.41) EPHX2MAPTKDM4EALDH1A1NPC1
SCHEMBL5819298 0.78 HKDC1 (0.50) MAPTKDM4EUSP2KMT2AMEN1
SCHEMBL10494191 0.75 EPHX2 (0.56) EPHX2MAPTKDM4EALDH1A1KMT2A
SCHEMBL9176608 0.74 MAPT (0.52) MAPTKDM4EALDH1A1USP2KMT2A
SCHEMBL30002739 0.74 MAPT (0.52) MAPTKDM4EALDH1A1USP2KMT2A
SCHEMBL5821723 0.71 EPHX2 (0.57) EPHX2MAPTKDM4EKMT2APOLB
SCHEMBL19303777 0.71 EGFR (0.38) MAPTKDM4EALDH1A1USP2KMT2A
SCHEMBL5820540 0.69 PTGS2 (0.39) MAPTKDM4EALDH1A1USP2KMT2A
SCHEMBL5821593 0.69 PTGS2 (0.39) MAPTKDM4EALDH1A1USP2KMT2A

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
US-4888026-A HAIR DYES; OXIDATION RESISTANCE L'OREAL (FR) 1989-12-19 — — US claimed
US-4888026-A HAIR DYES; OXIDATION RESISTANCE L'OREAL (FR) 1989-12-19 — — US disclosed
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