SCHEMBL14579726

SCHEMBL14579726

COc1ccc2c(c1)CCc1cc(OC(=O)c3cccc(C(C)=O)c3)ccc1-2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.54
▸ RAB9A P51151 5/20 0.54
▸ NPC1 O15118 5/20 0.54
▸ NFKB1 P19838 2/20 0.54
▸ NFKB2 Q00653 2/20 0.54
▸ RELA Q04206 2/20 0.54
▸ ESR1 P03372 1/20 0.52
▸ ESR2 Q92731 1/20 0.52
▸ KMT2A Q03164 6/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ CASP3 P42574 1/20 0.49
▸ SENP8 Q96LD8 1/20 0.49
▸ SENP7 Q9BQF6 1/20 0.49
▸ SENP6 Q9GZR1 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.46
▸ GAA P10253 2/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ GLA P06280 2/20 0.46

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
SCHEMBL14579698 0.90 KMT2A (0.47) MAPTRAB9ANPC1NFKB1NFKB2
SCHEMBL14579688 0.88 KMT2A (0.53) MAPTRAB9ANPC1NFKB1NFKB2
SCHEMBL14579696 0.88 KMT2A (0.50) MAPTRAB9ANPC1NFKB1NFKB2
SCHEMBL14579692 0.86 KMT2A (0.51) MAPTRAB9ANPC1NFKB1NFKB2
SCHEMBL14579677 0.84 KMT2A (0.67) MAPTRAB9ANPC1ESR1ESR2
SCHEMBL14579694 0.84 KMT2A (0.49) MAPTRAB9ANPC1NFKB1NFKB2
SCHEMBL17018619 0.83 ESR1 (0.68) MAPTRAB9ANPC1ESR1ESR2
SCHEMBL14579691 0.83 KMT2A (0.51) MAPTRAB9ANPC1NFKB1NFKB2
SCHEMBL10022910 0.82 KMT2A (0.56) MAPTRAB9ANPC1ESR1ESR2
SCHEMBL11758692 0.82 ESR1 (0.74) RAB9ANPC1ESR1ESR2KMT2A

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-7175955-B2 Electrophotographic photoreceptor, electrophotographic process cartridge and image forming apparatus FUJI XEROX CO., LTD. (JP) 2007-02-13 — — US disclosed
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