SCHEMBL13869810

SCHEMBL13869810

Cc1c(-c2ccc(-c3ccc4c(c3)-c3cc(-c5cnc(-c6cc7ccc8ccccc8c7oc6=O)cn5)ccc3C4(C)C)o2)c(=O)oc2ccc3ccccc3c12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.34
▸ KMT2A Q03164 5/20 0.34
▸ ALDH1A1 P00352 5/20 0.34
▸ KDM4E B2RXH2 4/20 0.34
▸ MAPT P10636 4/20 0.34
▸ HPGD P15428 4/20 0.34
▸ CYP3A4 P08684 3/20 0.34
▸ CYP1A2 P05177 3/20 0.34
▸ GAA P10253 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ MAOA P21397 2/20 0.32
▸ MAOB P27338 2/20 0.32
▸ ABCG2 Q9UNQ0 3/20 0.32
▸ AHR P35869 2/20 0.32
▸ CYP2C9 P11712 2/20 0.31
▸ CYP2C19 P33261 2/20 0.31
▸ GLA P06280 1/20 0.31
▸ ESR1 P03372 1/20 0.31

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
SCHEMBL13869787 0.79 ALDH1A1 (0.35) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL13869799 0.78 KDM4E (0.48) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL13869305 0.74 RAB9A (0.42) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL13886434 0.74 MEN1 (0.34) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL13869462 0.74 MAOA (0.39) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL13869701 0.73 KDM4E (0.39) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL13869677 0.73 KDM4E (0.34) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL13869656 0.73 MAOB (0.41) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL13869816 0.71 KDM4E (0.56) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL13869429 0.71 CYP1A2 (0.58) MEN1KMT2AALDH1A1KDM4EMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514158-B2 Coumarin compound KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2009-04-07 — — US disclosed
US-7514158-B2 Coumarin compound KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2009-04-07 — — US disclosed
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