SCHEMBL31424840

SCHEMBL31424840

Cc1nc2c(-c3ccccc3)cc(CBr)cc2[nH]c1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.38
RAB9A P51151 3/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
CHEK1 O14757 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 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
SCHEMBL31424804 0.88 DHODH (0.41) L3MBTL1TP53POLBRAB9ACHEK1
SCHEMBL31424711 0.87 KMT2A (0.41) KMT2AKDM4EALDH1A1CDK5CDK5R1
SCHEMBL31424753 0.87 ADORA3 (0.41) KDM4EALDH1A1GRIN1GRIN2B
SCHEMBL31424600 0.85 SLC2A1 (0.39) RAB9AMEN1NPC1KMT2ASMN1; SMN2
SCHEMBL31424846 0.85 ALDH1A1 (0.44) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL31424818 0.84 DHODH (0.37) MEN1KMT2ASMN1; SMN2KDM4EALDH1A1
SCHEMBL31424706 0.80 MAPK1 (0.40) CHEK1MAPK1
SCHEMBL30979307 0.79 GRIN2D (0.36) POLBKDM4EALDH1A1HTTGRIN2D
SCHEMBL30979321 0.78 GRIN2D (0.35) KDM4EALDH1A1HTTTDP1RXFP1
SCHEMBL30979299 0.77 PARP1 (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120020129-A Substituted nitrogen-containing bicyclic compounds and uses thereof 广东东阳光药业股份有限公司 2025-05-20 CN disclosed
CN-119431314-A Substituted nitrogen-containing bicyclic compounds and uses thereof 广东东阳光药业股份有限公司 2025-02-14 CN disclosed