SCHEMBL28539107

SCHEMBL28539107

CCOC(=O)c1cc(C(=O)c2ccc3ccccc3c2O)c2ccccn12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ GLA P06280 2/20 0.49
▸ GAA P10253 2/20 0.49
▸ HPGD P15428 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.47
▸ CDC25B P30305 1/20 0.46
▸ FNTA P49354 3/20 0.45
▸ FNTB P49356 3/20 0.45
▸ HCRTR1 O43613 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ CRHBP P24387 1/20 0.42
▸ CRHR2 Q13324 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ NOD2 Q9HC29 2/20 0.41

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
SCHEMBL28532373 0.82 ALDH1A1 (0.55) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL17339148 0.78 ALDH1A1 (0.61) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL28540023 0.77 FNTA (0.55) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL8773458 0.76 HCRTR1 (0.62) KDM4EALDH1A1GLAGAACDC25B
SCHEMBL6442064 0.76 KDM4E (0.53) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL28910370 0.75 FNTA (0.50) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL28531366 0.75 FNTA (0.48) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL17339205 0.74 KDM4E (0.58) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL9535179 0.73 KDM4E (0.69) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL17339192 0.71 KDM4E (0.56) KDM4EALDH1A1GLAGAAHPGD

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
CN-111875601-A Synthetic method and application of indolizine compound 遵义医科大学 2020-11-03 — — CN disclosed
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