SCHEMBL9566867

SCHEMBL9566867

CCCCCCOc1ccc(NC(=O)c2ccc(COC)nc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
STAT3 P40763 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
NR1H4 Q96RI1 2/20 0.52
MAPT P10636 4/20 0.51
HSD17B10 Q99714 3/20 0.51
P4HTM Q9NXG6 2/20 0.51
HPGD P15428 2/20 0.51
KDM4E B2RXH2 2/20 0.51
HTT P42858 1/20 0.51
PLK1 P53350 1/20 0.51
RAB9A P51151 2/20 0.50
NPC1 O15118 1/20 0.50
TSHR P16473 3/20 0.49
TAAR1 Q96RJ0 1/20 0.49
FAAH O00519 6/20 0.49
ALDH1A1 P00352 1/20 0.49
MCL1 Q07820 1/20 0.49
TP53 P04637 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
SCHEMBL9566796 0.90 LMNA (0.56) LMNASTAT3SMN1; SMN2NR1H4MAPT
SCHEMBL9566884 0.89 SMN1; SMN2 (0.55) LMNASTAT3SMN1; SMN2NR1H4MAPT
SCHEMBL9566790 0.89 LMNA (0.59) LMNASTAT3SMN1; SMN2NR1H4MAPT
SCHEMBL9566897 0.87 P4HTM (0.66) LMNASMN1; SMN2MAPTHSD17B10P4HTM
SCHEMBL9566821 0.86 NR1H4 (0.54) LMNASTAT3SMN1; SMN2NR1H4MAPT
SCHEMBL9566892 0.86 PLK1 (0.53) LMNASTAT3SMN1; SMN2NR1H4P4HTM
SCHEMBL9566731 0.84 TRPV1 (0.56) SMN1; SMN2KDM4ERAB9ANPC1ALDH1A1
SCHEMBL9566891 0.81 P4HTM (0.49) LMNASMN1; SMN2MAPTP4HTMKDM4E
SCHEMBL8390939 0.81 SMN1; SMN2 (0.67) LMNASTAT3SMN1; SMN2NR1H4MAPT
SCHEMBL8756930 0.81 SMN1; SMN2 (0.67) LMNASTAT3SMN1; SMN2NR1H4MAPT

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
EP-0533130-A1 2-Hydroxymethylpyridines, the corresponding pyridine-N-oxides and derivatives thereof, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-24 EP disclosed