SCHEMBL6124834

SCHEMBL6124834

CCC(CC(C)c1ccc(OC(=O)c2ccccc2)cc1)c1ccc(OC(=O)/C=C/c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 9/20 0.50
▸ MAPT P10636 6/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ RAB9A P51151 2/20 0.40
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ PKM P14618 1/20 0.39
▸ LTB4R Q15722 1/20 0.38
▸ LTB4R2 Q9NPC1 1/20 0.38
▸ SLC6A2 P23975 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38

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
SCHEMBL6124815 0.94 KMT2A (0.45) KMT2AMAPTKDM4ERAB9AMAOA
SCHEMBL6124820 0.91 KMT2A (0.46) KMT2AMAPTKDM4EMAOAMAOB
SCHEMBL6124827 0.90 KMT2A (0.45) KMT2AMAPTRAB9AMAOAMAOB
SCHEMBL6124835 0.89 KMT2A (0.49) KMT2AMAPTMAOAMAOBMEN1
SCHEMBL16200771 0.89 KMT2A (0.48) KMT2AMAPTKDM4ERAB9AMEN1
SCHEMBL6124826 0.88 KMT2A (0.43) KMT2AMAPTSMN1; SMN2TDP1
SCHEMBL12160205 0.83 KMT2A (0.59) KMT2AMAPTRAB9AMAOAMAOB
SCHEMBL6721979 0.77 ALDH1A1 (0.56) KMT2AMAPTKDM4ERAB9ANPC1
SCHEMBL21322445 0.76 KMT2A (0.67) KMT2AMAPTKDM4ERAB9ANPC1
SCHEMBL15163750 0.75 KMT2A (0.49) KMT2ARAB9AMAOAMAOBNPC1

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-8436068-B2 Composition and polymer INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-05-07 — — US disclosed
US-20120108697-A1 Composition and Polymer INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-05-03 — — US disclosed
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