SCHEMBL31364102

SCHEMBL31364102

O=c1ccn2[nH]cnc(=O)c2c1OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KMT2A Q03164 2/20 0.47
HPGD P15428 1/20 0.47
POLB P06746 1/20 0.44
NPC1 O15118 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
EGLN1 Q9GZT9 2/20 0.38
PKM P14618 1/20 0.35
GSTP1 P09211 1/20 0.35
MAPK14 Q16539 1/20 0.35
CDC7 O00311 1/20 0.35
DBF4 Q9UBU7 1/20 0.35
ELANE P08246 1/20 0.35

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
SCHEMBL31364060 0.69 EGLN1 (0.43) EGLN1
SCHEMBL10561186 0.66 HTT (0.69) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL29076843 0.65 HTT (0.68) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL10404509 0.64 HTT (0.79) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL6326241 0.64 HTT (0.55) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL9741442 0.64 HTT (1.00) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL8370127 0.64 LMNA (0.53) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL13003556 0.63 HTT (0.77) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL22868133 0.63 HTT (0.97) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL22049534 0.63 HTT (0.50) HTTSMN1; SMN2MEN1ALDH1A1KMT2A

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-119176807-A Alpha-hydroxy ketone nitrogen-containing fused ring compound and application thereof 北京英飞智药科技有限公司 2024-12-24 CN disclosed