SCHEMBL13865060

SCHEMBL13865060

COc1c(C)cc(C(C)(C)c2cc(C)c(OC(=O)c3ccc(C(=O)Oc4c(C)cc(C(C)(C)c5cc(C)c(OC(=O)c6cccc(C(C)=O)c6)c(C)c5)cc4C)cc3)c(C)c2)cc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.39
▸ ESR2 Q92731 1/20 0.39
▸ MAPT P10636 7/20 0.39
▸ ALDH1A1 P00352 5/20 0.39
▸ POLB P06746 2/20 0.39
▸ GFER P55789 1/20 0.39
▸ KMT2A Q03164 9/20 0.37
▸ MEN1 O00255 5/20 0.37
▸ PKM P14618 3/20 0.37
▸ L3MBTL1 Q9Y468 3/20 0.37
▸ GAA P10253 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ CREBBP Q92793 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37

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
SCHEMBL14007584 0.97 ESR1 (0.39) ESR1ESR2MAPTALDH1A1POLB
SCHEMBL12346020 0.97 ESR1 (0.41) ESR1ESR2MAPTALDH1A1POLB
SCHEMBL16573870 0.91 KMT2A (0.39) MAPTALDH1A1KMT2AMEN1PKM
SCHEMBL12346021 0.91 KMT2A (0.39) MAPTALDH1A1KMT2AMEN1PKM
SCHEMBL13161683 0.87 MAPT (0.48) ESR1ESR2MAPTALDH1A1POLB
SCHEMBL13084504 0.86 ESR1 (0.36) ESR1ESR2MAPTALDH1A1POLB
SCHEMBL12762428 0.85 MAPT (0.43) ESR1ESR2MAPTALDH1A1POLB
SCHEMBL142008 0.85 MAPT (0.38) ESR1ESR2MAPTALDH1A1POLB
SCHEMBL12971606 0.85 KMT2A (0.35) ESR1ESR2MAPTALDH1A1POLB
SCHEMBL17753752 0.85 MAPT (0.47) MAPTALDH1A1KMT2AL3MBTL1GAA

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
US-20090123854-A1 IMAGE FORMING METHOD KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2009-05-14 — — US disclosed
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