SCHEMBL30833152

SCHEMBL30833152

COCCOc1cc2[nH]ccc2cc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.41
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
TYR P14679 1/20 0.40
USP2 O75604 1/20 0.40
GAA P10253 1/20 0.40
ALOX15 P16050 1/20 0.40
RAD51 Q06609 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
APP P05067 1/20 0.39
MAPT P10636 1/20 0.39
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
PRKCQ Q04759 2/20 0.38
GPR84 Q9NQS5 1/20 0.37
NR4A2 P43354 2/20 0.36
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36

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
SCHEMBL15952462 1.00 BACE1 (0.41) BACE1MEN1POLBMAPK1KMT2A
SCHEMBL15951984 0.92 BACE1 (0.41) BACE1MEN1POLBMAPK1KMT2A
SCHEMBL15952629 0.85 NCF1 (0.38) BACE1MEN1POLBMAPK1KMT2A
SCHEMBL9735678 0.84 MEN1 (0.40) BACE1MEN1POLBMAPK1KMT2A
SCHEMBL15953327 0.84 PTK6 (0.45) BACE1MEN1POLBMAPK1KMT2A
SCHEMBL9736720 0.82 SMPD1 (0.46) MEN1KMT2ATYRMAPTTLR8
SCHEMBL1959555 0.82 POLB (0.50) BACE1MEN1POLBMAPK1KMT2A
SCHEMBL15952457 0.81 GPR84 (0.41) BACE1MEN1POLBMAPK1KMT2A
SCHEMBL9735907 0.80 SMPD1 (0.44) MEN1KMT2AMAPTTLR8GPR84
SCHEMBL8052978 0.78 MEN1 (0.40) BACE1MEN1POLBMAPK1KMT2A

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-117677613-A Process for producing synthetic intermediate of monocyclic pyridine derivative 卫材R&D管理有限公司 2024-03-08 CN disclosed