SCHEMBL11086572

SCHEMBL11086572

CCOC(=O)Oc1ccc(C(=O)OCCN2CCN(CCN3CCOCC3)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.64
▸ KDM4E B2RXH2 4/20 0.62
▸ ALDH1A1 P00352 4/20 0.62
▸ HPGD P15428 1/20 0.62
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ SMN1; SMN2 Q16637 4/20 0.55
▸ GAA P10253 3/20 0.54
▸ PKM P14618 1/20 0.49
▸ CYP1A2 P05177 1/20 0.48
▸ LMNA P02545 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ MAPT P10636 2/20 0.48
▸ THRB P10828 1/20 0.48
▸ TSHR P16473 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ STAT3 P40763 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ KCNH2 Q12809 1/20 0.47
▸ HRH3 Q9Y5N1 1/20 0.47

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
SCHEMBL14369835 0.84 ATM (0.68) ATMKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL4441360 0.83 SMN1; SMN2 (0.73) ATMKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL501199 0.83 ATM (0.73) ATMKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL8489898 0.82 ATM (0.77) ATMKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL10174568 0.81 ATM (0.75) ATMKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL14369836 0.81 ATM (0.75) ATMKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL11081554 0.80 ATM (0.97) ATMKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL5214308 0.80 HRH3 (0.72) KDM4EALDH1A1HPGDSMN1; SMN2GAA
SCHEMBL11201848 0.79 ATM (1.00) ATMKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL24177835 0.78 ATM (0.70) ATMKDM4EALDH1A1HPGDL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4443603-A PROTEOLYTIC ENZYME INHIBITORS KOWA COMPANY LIMITED (JP) 1984-04-17 — — US disclosed
EP-0071433-A1 Medicine for the treatment of diabetes KOWA COMPANY, LTD. (JP) 1983-02-09 — — EP disclosed
EP-0067561-A2 Piperazine derivatives and processes for producing them KOWA COMPANY, LTD. (JP) 1982-12-22 — — EP disclosed
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