SCHEMBL11399753

SCHEMBL11399753

CN(C)C(=O)Nc1cc2ccccc2oc1=O

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.71
ALDH1A1 P00352 4/20 0.71
KDM4E B2RXH2 4/20 0.71
HPGD P15428 2/20 0.71
CYP1A2 P05177 2/20 0.71
HSD17B10 Q99714 2/20 0.71
LMNA P02545 1/20 0.71
MAOA P21397 1/20 0.71
MAOB P27338 14/20 0.63
NPC1 O15118 4/20 0.63
RAB9A P51151 4/20 0.63
PKM P14618 2/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
ACHE P22303 5/20 0.61
GAA P10253 1/20 0.57
MAPT P10636 1/20 0.57
CYP2C19 P33261 1/20 0.56

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
SCHEMBL893303 0.83 KDM4E (1.00) SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL28563825 0.81 SMN1; SMN2 (0.74) SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11391879 0.81 SMN1; SMN2 (0.73) SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11396751 0.79 MAOB (0.71) SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL28682651 0.78 MAOB (0.70) SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL17664186 0.77 MAOB (0.68) SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11393213 0.76 MAOA (0.48) SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11321171 0.76 MAOB (1.00) SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL2777639 0.76 KDM4E (0.66) SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL28348714 0.76 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1KDM4EHPGDCYP1A2

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-4259506-A SELECTIVELY DESTROYING WEEDS IN CROPS PHILAGRO (FR) 1981-03-31 US disclosed