SCHEMBL30669347

SCHEMBL30669347

Cc1c(OCc2ccccc2)c(=O)ccn1C[C@@H](O)c1ccc(F)cc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.69
HTT P42858 3/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
ALDH1A1 P00352 2/20 0.60
HPGD P15428 1/20 0.60
NPC1 O15118 1/20 0.56
NPSR1 Q6W5P4 2/20 0.55
IDO1 P14902 2/20 0.43
KDM4E B2RXH2 1/20 0.42
LMNA P02545 2/20 0.40
MAPT P10636 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL30669315 1.00 SMN1; SMN2 (0.69) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL30669327 0.92 HTT (0.67) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL30669370 0.92 HTT (0.67) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL30669383 0.91 HTT (0.67) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL30669399 0.91 HTT (0.67) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL30669362 0.89 NPSR1 (0.70) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL30669376 0.89 NPSR1 (0.70) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL30669360 0.89 SMN1; SMN2 (0.57) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL30669356 0.88 HTT (0.59) SMN1; SMN2HTTMEN1KMT2AALDH1A1
SCHEMBL30669328 0.88 HTT (0.59) SMN1; SMN2HTTMEN1KMT2AALDH1A1

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
CN-117105853-A 3-hydroxypyridine-4 (H) -ketone derivative, and preparation method and application thereof 浙江工业大学 2023-11-24 CN disclosed