SCHEMBL11625985

SCHEMBL11625985

CCOC(=O)c1nsnc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.51
LMNA P02545 1/20 0.51
ALDH1A1 P00352 6/20 0.43
HPGD P15428 4/20 0.43
CYP1A2 P05177 1/20 0.42
MAPT P10636 3/20 0.42
GAA P10253 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 2/20 0.41
CDC7 O00311 1/20 0.40
DBF4 Q9UBU7 1/20 0.40
TSHR P16473 1/20 0.40
FHIT P49789 1/20 0.39
TARBP2 Q15633 1/20 0.38
PDCD4 Q53EL6 1/20 0.38
MAPK1 P28482 2/20 0.38
ALOX15 P16050 2/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37

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
SCHEMBL13382296 0.79 KDM4E (0.55) KDM4ELMNAALDH1A1HPGDCYP1A2
SCHEMBL4553774 0.76 KDM4E (0.56) KDM4ELMNAALDH1A1HPGDCYP1A2
SCHEMBL16346557 0.72 KDM4E (0.49) KDM4ELMNAALDH1A1HPGDCYP1A2
SCHEMBL14008452 0.71 KDM4E (0.39) KDM4ELMNAALDH1A1HPGDCYP1A2
SCHEMBL16571310 0.70 HSD17B2 (0.44) KDM4ELMNAALDH1A1HPGDCYP1A2
SCHEMBL1412618 0.70 ELANE (0.42) ALDH1A1HPGDCYP1A2SMN1; SMN2MAPK1
SCHEMBL23830291 0.69 HSD17B10 (0.56) KDM4EALDH1A1HPGDCYP1A2MAPT
SCHEMBL11563324 0.69 TSHR (0.46) KDM4ELMNAALDH1A1HPGDMAPT
SCHEMBL21410580 0.68 KDM4E (0.45) KDM4ELMNAALDH1A1HPGDMAPT
SCHEMBL7543209 0.68 ALDH1A1 (0.43) LMNAALDH1A1HPGDCYP1A2MAPT

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
US-4119727-A HYPOTENSIVE AGENTS ROUSSEL UCLAF (FR) 1978-10-10 US disclosed