SCHEMBL19262138

SCHEMBL19262138

CC(C)C(=O)Nc1cccc(P(=O)(O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.56
LMNA P02545 2/20 0.56
ALDH1A1 P00352 8/20 0.54
KMT2A Q03164 5/20 0.54
MEN1 O00255 4/20 0.54
MAPT P10636 2/20 0.54
RXFP1 Q9HBX9 1/20 0.54
F2R P25116 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
RAB9A P51151 4/20 0.51
NPC1 O15118 3/20 0.51
TP53 P04637 2/20 0.51
TSHR P16473 2/20 0.51
HTT P42858 2/20 0.51
POLB P06746 1/20 0.51
HSD17B10 Q99714 1/20 0.51
MTNR1B P49286 1/20 0.50
ALOX12 P18054 1/20 0.48
KDM4E B2RXH2 2/20 0.48
GAA P10253 1/20 0.48

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
SCHEMBL13924990 0.85 MEN1 (0.45) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL13904082 0.85 MEN1 (0.45) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL19262173 0.77 RAB9A (0.61) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL8209236 0.76 MEN1 (0.60) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL12574796 0.76 TDP1 (0.62) SMN1; SMN2ALDH1A1KMT2ARXFP1L3MBTL1
SCHEMBL11866935 0.76 SMN1; SMN2 (0.63) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL26386086 0.76 SMN1; SMN2 (0.63) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL13391043 0.76 HSD17B10 (0.67) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL2735680 0.76 HSD17B10 (0.65) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL2384797 0.76 ALDH1A1 (0.65) SMN1; SMN2LMNAALDH1A1KMT2AMEN1

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-9738064-B2 Lithographic printing plate precursor AGFA GRAPHICS N.V. (BE) 2017-08-22 US disclosed