SCHEMBL14007583

SCHEMBL14007583

COc1cc(C)c(C(C)(C)c2c(C)cc(OC(=O)c3cccc(C(=O)Oc4cc(C)c(C(C)(C)c5c(C)cc(OC(=O)c6ccc(C(C)=O)cc6)cc5C)c(C)c4)c3)cc2C)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.47
▸ ESR2 Q92731 1/20 0.47
▸ KMT2A Q03164 11/20 0.42
▸ MEN1 O00255 4/20 0.41
▸ MAPT P10636 4/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ PRSS1 P07477 2/20 0.40
▸ ACR P10323 2/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CASP3 P42574 1/20 0.39
▸ SENP8 Q96LD8 1/20 0.39
▸ SENP7 Q9BQF6 1/20 0.39
▸ SENP6 Q9GZR1 1/20 0.39

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
SCHEMBL141562 0.95 ESR1 (0.49) ESR1ESR2KMT2AMEN1MAPT
SCHEMBL142005 0.84 CA1 (0.51) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL14007586 0.83 ESR1 (0.51) ESR1ESR2KMT2AMEN1MAPT
SCHEMBL12925841 0.80 MAPT (0.52) ESR1ESR2KMT2AMEN1MAPT
SCHEMBL13258485 0.80 ESR1 (0.52) ESR1ESR2KMT2AMEN1MAPT
SCHEMBL14579686 0.79 KMT2A (0.50) KMT2AMEN1MAPTSMN1; SMN2CYP1A2
SCHEMBL12971601 0.78 MAPT (0.52) ESR1ESR2KMT2AMEN1MAPT
SCHEMBL14007584 0.77 ESR1 (0.39) ESR1ESR2KMT2AMEN1MAPT
SCHEMBL13085851 0.76 ESR1 (0.64) ESR1ESR2KMT2AMEN1MAPT
SCHEMBL14701064 0.75 KMT2A (0.42) KMT2AMEN1MAPTSMN1; SMN2KDM4E

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-7449271-B2 Electrophotographic photoconductor and methods therefor FUJI ELECTRIC DEVICE TECHNOLOGY CO., LTD. (JP) 2008-11-11 — — US disclosed
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