SCHEMBL3632563

SCHEMBL3632563

CCN(CC)c1ccc2c(CCN3C(=O)C=CC3=O)c(C(N)=O)c(=O)oc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 10/20 0.51
▸ ATM Q13315 7/20 0.51
▸ KDM4E B2RXH2 7/20 0.51
▸ GLA P06280 5/20 0.51
▸ GAA P10253 2/20 0.51
▸ KLK7 P49862 1/20 0.51
▸ MAPT P10636 6/20 0.48
▸ MEN1 O00255 5/20 0.48
▸ KMT2A Q03164 5/20 0.48
▸ HPGD P15428 5/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ EP300 Q09472 1/20 0.46
▸ HSD17B10 Q99714 5/20 0.46
▸ HTT P42858 4/20 0.46
▸ L3MBTL1 Q9Y468 4/20 0.46
▸ CASP1 P29466 4/20 0.46
▸ CASP7 P55210 4/20 0.46
▸ LMNA P02545 2/20 0.46
▸ THRB P10828 1/20 0.46
▸ TDP1 Q9NUW8 2/20 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
SCHEMBL18038410 0.73 ALDH1A1 (0.58) ALDH1A1ATMKDM4EGLAGAA
SCHEMBL592818 0.71 ALDH1A1 (0.60) ALDH1A1ATMKDM4EGLAGAA
SCHEMBL29415447 0.71 ALDH1A1 (0.60) ALDH1A1ATMKDM4EGLAGAA
SCHEMBL29358600 0.70 KMT2A (0.61) ALDH1A1ATMKDM4EMAPTMEN1
SCHEMBL1908058 0.70 KMT2A (0.61) ALDH1A1ATMKDM4EMAPTMEN1
SCHEMBL28473974 0.69 ALDH1A1 (0.58) ALDH1A1ATMKDM4EGLAGAA
SCHEMBL24589380 0.69 ALDH1A1 (0.81) ALDH1A1ATMKDM4EGLAGAA
SCHEMBL28350492 0.69 ALDH1A1 (0.67) ALDH1A1ATMKDM4EGLAGAA
SCHEMBL4390559 0.68 ALDH1A1 (1.00) ALDH1A1ATMKDM4EGLAGAA
SCHEMBL3363523 0.68 EP300 (0.69) ALDH1A1ATMKDM4EGLAGAA

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
EP-2170937-A1 LABELED SINGLE-STRAND DNA-BINDING PROTEIN AND ITS USE IN A BIOSENSOR FOR DETECTION AND VISUALISATION OF SINGLE-STRANDED DNA Medical Research Council (GB) 2010-04-07 — — EP claimed
WO-2008152379-A1 LABELED SINGLE-STRAND DNA-BINDING PROTEIN AND ITS USE IN A BIOSENSOR FOR DETECTION AND VISUALISATION OF SINGLE-STRANDED DNA MEDICAL RESEARCH COUNCIL (GB) 2008-12-18 — — WO claimed
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