SCHEMBL13869656

SCHEMBL13869656

Cc1c(-c2cnc(-c3cccc4c(-c5cccc6c(-c7ccc(-c8cc9ccc%10ccccc%10c9oc8=O)s7)cccc56)cccc34)cn2)c(=O)oc2ccc3ccccc3c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.41
▸ MAOA P21397 1/20 0.41
▸ MAPT P10636 8/20 0.38
▸ ALDH1A1 P00352 6/20 0.38
▸ KDM4E B2RXH2 4/20 0.38
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ GAA P10253 2/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ TP53 P04637 3/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ PIM1 P11309 1/20 0.35
▸ LMNA P02545 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ IKBKB O14920 1/20 0.34

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
SCHEMBL13869816 0.80 KDM4E (0.56) MAOBMAOAMAPTALDH1A1KDM4E
SCHEMBL13869585 0.80 MAPT (0.34) MAOBMAOAMAPTALDH1A1KDM4E
SCHEMBL13869478 0.78 KDM4E (0.54) MAOBMAOAMAPTALDH1A1KDM4E
SCHEMBL13869632 0.78 ALDH1A1 (0.37) MAOBMAOAMAPTALDH1A1KDM4E
SCHEMBL13869496 0.76 ALDH1A1 (0.42) MAOBMAOAMAPTALDH1A1KDM4E
SCHEMBL13869677 0.74 KDM4E (0.34) MAOBMAOAMAPTALDH1A1KDM4E
SCHEMBL13869787 0.74 ALDH1A1 (0.35) MAOBMAOAMAPTALDH1A1KDM4E
SCHEMBL13869608 0.74 ADORA3 (0.40) MAOBMAOAMAPTALDH1A1KDM4E
SCHEMBL13886324 0.73 MEN1 (0.34) MAOBMAOAMAPTALDH1A1KDM4E
SCHEMBL13869810 0.73 MEN1 (0.34) MAOBMAOAMAPTALDH1A1KDM4E

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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