SCHEMBL9566797

SCHEMBL9566797

O=C(Nc1cccc(Cl)c1)c1ccc(CO)nc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 1/20 0.67
NPC1 O15118 3/20 0.57
RAB9A P51151 3/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
LMNA P02545 2/20 0.54
MAPT P10636 1/20 0.54
GRM4 Q14833 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
ALDH1A1 P00352 2/20 0.53
POLB P06746 1/20 0.53
KCNQ3 O43525 2/20 0.52
KCNQ2 O43526 2/20 0.52
KCNE1 P15382 2/20 0.52
KCNQ1 P51787 2/20 0.52
KCNQ5 Q9NR82 1/20 0.52
ADORA3 P0DMS8 1/20 0.52
ADORA2A P29274 1/20 0.52
ADORA2B P29275 1/20 0.52

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
SCHEMBL9566778 0.85 P4HTM (0.61) P4HTMNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9566835 0.83 P4HTM (0.63) P4HTMNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9566802 0.83 NPC1 (0.67) P4HTMNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9566795 0.83 P4HTM (0.59) P4HTMNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL12020444 0.83 P4HTM (0.62) P4HTMNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9566807 0.83 P4HTM (0.59) P4HTMNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9566789 0.81 P4HTM (0.60) P4HTMNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9566888 0.81 P4HTM (0.57) P4HTMNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL3645995 0.81 P4HTM (0.70) P4HTMNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9566901 0.81 KMT2A (0.62) SMN1; SMN2MEN1KMT2ALMNAMAPT

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