SCHEMBL31473297

SCHEMBL31473297

COc1ccccc1Nn1cnc2c(cnn2C)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
USP2 O75604 2/20 0.46
LMNA P02545 2/20 0.46
ALDH1A1 P00352 4/20 0.46
RXFP1 Q9HBX9 2/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.43
HTT P42858 3/20 0.43
ALDH1A2 O94788 1/20 0.43
ALDH1A3 P47895 1/20 0.43
POLB P06746 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
NPC1 O15118 3/20 0.41
GAA P10253 2/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 2/20 0.40
PKM P14618 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GLA P06280 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
SCHEMBL31473285 0.85 KMT2A (0.47) SMN1; SMN2LMNAALDH1A1RXFP1KMT2A
SCHEMBL31473314 0.84 TP53 (0.52) SMN1; SMN2ALDH1A1RXFP1KMT2AMEN1
SCHEMBL31473322 0.82 KMT2A (0.47) SMN1; SMN2LMNAALDH1A1RXFP1KMT2A
SCHEMBL31473316 0.82 KMT2A (0.47) SMN1; SMN2LMNAALDH1A1RXFP1KMT2A
SCHEMBL31473323 0.82 MEN1 (0.47) SMN1; SMN2LMNAALDH1A1RXFP1KMT2A
SCHEMBL31473303 0.81 MEN1 (0.53) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL31473289 0.77 GAA (0.42) SMN1; SMN2LMNAALDH1A1RXFP1KMT2A
SCHEMBL31473315 0.76 NPC1 (0.45) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL31473320 0.76 MEN1 (0.40) SMN1; SMN2LMNAALDH1A1RXFP1KMT2A
SCHEMBL31473293 0.74 HAVCR2 (0.51) SMN1; SMN2LMNAALDH1A1RXFP1KMT2A

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-119390700-A Pyrazolopyrimidinone derivative containing aniline unit, and preparation method and application thereof 江苏海洋大学 2025-02-07 CN disclosed