SCHEMBL6060518

SCHEMBL6060518

Cc1ccc2c(c1)n(CCO)c(=O)n2CCO

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ HPD P32754 5/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ ADORA2A P29274 1/20 0.40
▸ ADORA2B P29275 1/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ CXCR3 P49682 2/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CYP1A2 P05177 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
SCHEMBL6059612 0.90 MEN1 (0.51) KMT2AMEN1HPDALDH1A1KDM4E
SCHEMBL25886216 0.84 MEN1 (0.55) KMT2AMEN1HPDALDH1A1KDM4E
SCHEMBL11710858 0.83 KMT2A (0.52) KMT2AMEN1ALDH1A1KDM4EGAA
SCHEMBL22700962 0.79 MEN1 (0.48) KMT2AMEN1HPDALDH1A1KDM4E
SCHEMBL11737976 0.79 CCNB2 (0.41) HPDALDH1A1KDM4EGAAMAPT
SCHEMBL3697820 0.77 APEX1 (0.55) ALDH1A1GAAMAPTPOLBL3MBTL1
SCHEMBL6060454 0.76 MEN1 (0.48) KMT2AMEN1HPDALDH1A1KDM4E
SCHEMBL2967754 0.75 MEN1 (0.50) KMT2AMEN1ALDH1A1KDM4EGAA
SCHEMBL22700980 0.74 KMT2A (0.62) KMT2AMEN1ALDH1A1KDM4EGAA
SCHEMBL11999839 0.73 KDM4E (0.56) KMT2AMEN1ALDH1A1KDM4EGAA

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-20060155096-A1 Thermoplastic polymer, thermoplastic polymer composition, antistatic agent, and resin composition MITSUI TAKEDA CHEMICALS, INC. (JP) 2006-07-13 — — US disclosed
EP-1541608-A1 THERMOPLASTIC POLYMER, THERMOPLASTIC POLYMER COMPOSITION, ANTISTATIC AGENT, AND RESIN COMPOSITION MITSUI TAKEDA CHEMICALS, INC. (JP) 2005-06-15 — — EP disclosed
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