SCHEMBL10432589

SCHEMBL10432589

COc1cccc(-c2cc(=O)c3c(N)cccc3o2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 7/20 0.65
▸ KDM4E B2RXH2 6/20 0.65
▸ ALDH1A1 P00352 5/20 0.65
▸ HSD17B10 Q99714 4/20 0.65
▸ HPGD P15428 3/20 0.65
▸ SMN1; SMN2 Q16637 3/20 0.65
▸ MAPK1 P28482 2/20 0.65
▸ USP2 O75604 1/20 0.65
▸ RECQL P46063 1/20 0.65
▸ ESR1 P03372 1/20 0.59
▸ ESR2 Q92731 1/20 0.59
▸ MAPT P10636 5/20 0.58
▸ TP53 P04637 5/20 0.58
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ CYP2C9 P11712 3/20 0.58
▸ CYP2C19 P33261 3/20 0.58
▸ TSHR P16473 2/20 0.58
▸ AR P10275 2/20 0.56
▸ ABCG2 Q9UNQ0 3/20 0.53

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
SCHEMBL10432592 0.90 ESR1 (0.60) CYP3A4KDM4EALDH1A1HSD17B10HPGD
SCHEMBL10432584 0.88 ESR1 (0.68) CYP3A4KDM4EALDH1A1HSD17B10HPGD
SCHEMBL4649423 0.85 KDM4E (0.77) CYP3A4KDM4EALDH1A1HSD17B10HPGD
SCHEMBL4650052 0.84 CYP3A4 (0.68) CYP3A4KDM4EALDH1A1HSD17B10HPGD
SCHEMBL10432745 0.83 CYP3A4 (0.66) CYP3A4KDM4EALDH1A1HSD17B10HPGD
SCHEMBL10432787 0.82 LCK (0.56) CYP3A4KDM4EALDH1A1HSD17B10HPGD
SCHEMBL10433065 0.81 LCK (0.67) CYP3A4KDM4EALDH1A1HSD17B10HPGD
SCHEMBL2409142 0.81 ESR1 (0.75) CYP3A4KDM4EALDH1A1HSD17B10HPGD
SCHEMBL10433113 0.81 SIGMAR1 (0.59) ESR1ESR2CYP1A1CYP1A2MAOB
SCHEMBL360247 0.81 CYP3A4 (0.82) CYP3A4KDM4EALDH1A1HSD17B10HPGD

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
EP-0374789-A1 5- Aminoflavone derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1990-06-27 — — EP disclosed
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