SCHEMBL11033030

SCHEMBL11033030

O=C(Nn1cnnc1)c1ccccc1O

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.68
MEN1 O00255 4/20 0.68
KDM4E B2RXH2 5/20 0.56
ALDH1A1 P00352 4/20 0.56
HPGD P15428 2/20 0.56
USP2 O75604 1/20 0.56
MAPT P10636 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
PTGS1 P23219 1/20 0.54
PTGS2 P35354 1/20 0.54
GAA P10253 2/20 0.53
MPO P05164 1/20 0.53
HIF1A Q16665 1/20 0.53
TSHR P16473 1/20 0.50
LMNA P02545 2/20 0.49
TP53 P04637 2/20 0.49
HTT P42858 2/20 0.49
HSD17B10 Q99714 1/20 0.49
NPC1 O15118 1/20 0.49

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
SCHEMBL3470463 0.75 MEN1 (0.77) KMT2AMEN1ALDH1A1HPGDMAPT
SCHEMBL562017 0.73 KDM4E (0.50) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL4338282 0.73 KDM4E (0.50) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL1520599 0.73 MEN1 (0.65) KMT2AMEN1ALDH1A1SMN1; SMN2GAA
SCHEMBL10635304 0.73 KDM4E (0.50) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL11339136 0.72 KDM4E (0.65) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL77381 0.72 CA1 (0.77) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL70688 0.72 KDM4E (0.71) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL15033508 0.71 KDM4E (1.00) KMT2AMEN1KDM4EALDH1A1HPGD
SCHEMBL11650354 0.71 CA12 (0.58) KMT2AMEN1KDM4EALDH1A1HPGD

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-4426546-A FUNCTIONAL LAYER AND PAIR OF COPPER, OR COPPER ALLOY, ELECTRODES MATSUSHITA ELECTRIC INDUSTRIAL COMPANY, LIMITED (JP) 1984-01-17 US disclosed