SCHEMBL31322342

SCHEMBL31322342

O=c1[nH]cnc2c1cnc1ccccc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 12/20 0.68
PDPK1 O15530 1/20 0.68
CA12 O43570 1/20 0.68
ALOX15 P16050 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
CA9 Q16790 1/20 0.68
TNKS2 Q9H2K2 1/20 0.68
ACVR1 Q04771 2/20 0.51
PIM1 P11309 2/20 0.51
AURKA O14965 1/20 0.51
DAPK3 O43293 1/20 0.51
JAK2 O60674 1/20 0.51
PRKD3 O94806 1/20 0.51
MAP4K4 O95819 1/20 0.51
PAK4 O96013 1/20 0.51
ABL1 P00519 1/20 0.51
CSF1R P07333 1/20 0.51
RET P07949 1/20 0.51
IGF1R P08069 1/20 0.51
MET P08581 1/20 0.51

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
Quinazolinone SCHEMBL27983253 0.81 PARP1 (1.00) PARP1PDPK1CA12ALOX15SMN1; SMN2
Quinazolinone SCHEMBL88525 0.81 PARP1 (1.00) PARP1PDPK1CA12ALOX15SMN1; SMN2
Quinazolinone SCHEMBL29603643 0.80 PARP1 (0.96) PARP1PDPK1CA12ALOX15SMN1; SMN2
Quinazolinone SCHEMBL22442340 0.80 PARP1 (0.96) PARP1PDPK1CA12ALOX15SMN1; SMN2
Quinazolinone SCHEMBL28314056 0.80 PARP1 (0.96) PARP1PDPK1CA12ALOX15SMN1; SMN2
Quinazolinone SCHEMBL30408864 0.80 PARP1 (0.96) PARP1PDPK1CA12ALOX15SMN1; SMN2
Quinazolinone SCHEMBL8201420 0.80 PARP1 (0.96) PARP1PDPK1CA12ALOX15SMN1; SMN2
SCHEMBL20998623 0.80 PARP1 (0.96) PARP1PDPK1CA12ALOX15SMN1; SMN2
Quinazolinone SCHEMBL27896056 0.80 PARP1 (0.96) PARP1PDPK1CA12ALOX15SMN1; SMN2
Quinazolinone SCHEMBL28001142 0.80 PARP1 (0.96) PARP1PDPK1CA12ALOX15SMN1; SMN2

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-119497615-A TPK agonists and methods of using the same for treating neurodegenerative diseases 上海日馨医药科技股份有限公司 2025-02-21 CN disclosed