SCHEMBL14302829

SCHEMBL14302829

O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1CCc1cccc(Cl)c1)c64)C(=O)N(CCc1cccc(Cl)c1)C5=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.54
▸ MAPT P10636 3/20 0.54
▸ KDM4E B2RXH2 3/20 0.54
▸ RAB9A P51151 2/20 0.54
▸ GAA P10253 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ CYP1B1 Q16678 1/20 0.50
▸ TERT O14746 4/20 0.48
▸ ACHE P22303 4/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ TAAR1 Q96RJ0 1/20 0.46
▸ STAT3 P40763 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ ALDH2 P05091 1/20 0.45
▸ ALDH3A1 P30838 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ DAO P14920 1/20 0.45

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
SCHEMBL8685366 0.86 MAPT (0.60) MAPTKDM4ECYP1B1MEN1KMT2A
SCHEMBL8365206 0.83 TERT (0.55) ALDH1A1MAPTKDM4ERAB9AGAA
SCHEMBL14524631 0.83 TERT (0.51) ALDH1A1MAPTKDM4ERAB9AGAA
SCHEMBL14303166 0.82 TERT (0.53) ALDH1A1MAPTKDM4ERAB9AGAA
SCHEMBL31257229 0.82 TERT (0.53) ALDH1A1MAPTKDM4ERAB9AGAA
SCHEMBL29361586 0.82 ALDH1A1 (0.67) ALDH1A1MAPTKDM4ERAB9AGAA
SCHEMBL1630714 0.82 ALDH1A1 (0.67) ALDH1A1MAPTKDM4ERAB9AGAA
SCHEMBL24812474 0.82 TERT (0.47) ALDH1A1MAPTKDM4ERAB9AGAA
SCHEMBL14524630 0.81 HEXA (0.56) ALDH1A1MAPTKDM4ERAB9AGAA
SCHEMBL14524635 0.80 RAB9A (0.57) ALDH1A1MAPTKDM4ERAB9AGAA

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-0977754-B1 WRITABLE AND ERASABLE HIGH-DENSITY OPTICAL STORAGE MEDIA CIBA SC HOLDING AG (CH) 2008-01-16 — — EP disclosed
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