SCHEMBL19262175

SCHEMBL19262175

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.50
LMNA P02545 3/20 0.50
ALDH1A1 P00352 6/20 0.48
F2R P25116 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PTPRC P08575 1/20 0.48
HTT P42858 2/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
NPC1 O15118 2/20 0.44
TP53 P04637 2/20 0.44
TSHR P16473 2/20 0.44
RAB9A P51151 2/20 0.44
MAPT P10636 2/20 0.44
RXFP1 Q9HBX9 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
POLB P06746 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL19262164 0.84 PTPRC (0.51) SMN1; SMN2ALDH1A1L3MBTL1PTPRCRAB9A
SCHEMBL5950098 0.82 SMN1; SMN2 (0.58) SMN1; SMN2LMNAALDH1A1F2RL3MBTL1
SCHEMBL13555450 0.80 TDP1 (0.55) ALDH1A1L3MBTL1PTPRCMEN1KMT2A
SCHEMBL1924509 0.80 TGM2 (0.51) LMNAALDH1A1PTPRCHTTMEN1
SCHEMBL13555320 0.78 PTPRC (0.46) LMNAALDH1A1PTPRCMAPTHDAC3
SCHEMBL5561958 0.78 SMN1; SMN2 (0.63) SMN1; SMN2LMNAALDH1A1L3MBTL1HTT
SCHEMBL31093984 0.78 SMN1; SMN2 (0.63) SMN1; SMN2LMNAALDH1A1L3MBTL1HTT
SCHEMBL25111096 0.76 ALDH1A1 (0.53) SMN1; SMN2LMNAALDH1A1F2RL3MBTL1
SCHEMBL19262138 0.75 SMN1; SMN2 (0.56) SMN1; SMN2LMNAALDH1A1F2RL3MBTL1
SCHEMBL19262178 0.75 PTPRC (0.45) SMN1; SMN2LMNAALDH1A1PTPRCMEN1

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