SCHEMBL30727779

SCHEMBL30727779

Cc1cn2nc(Br)cc2c(Cl)n1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL24662921 0.83 SMN1; SMN2 (0.39) SMN1; SMN2NPC1RAB9AMAPTLMNA
SCHEMBL15068628 0.81 ALDH1A1 (0.31) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL25359012 0.75 PDE4B (0.32) SMN1; SMN2MAPTKMT2AALDH1A1MAPK1
SCHEMBL28529693 0.73 SMN1; SMN2 (0.44) SMN1; SMN2KMT2AALDH1A1MAPK1
SCHEMBL16376282 0.73 SMN1; SMN2 (0.37) SMN1; SMN2MAPTKMT2ALMNAL3MBTL1
SCHEMBL25456973 0.71 AHR (0.31)
SCHEMBL24163472 0.70 ALDH1A1 (0.41) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL31400377 0.70
SCHEMBL23756860 0.68
SCHEMBL31732100 0.67 HTT (0.33) SMN1; SMN2NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4532495-A1 CD73 INHIBITOR COMPOUNDS Adorx therapeutics Limited (GB) 2025-04-09 EP disclosed
CN-119585273-A CD73 inhibitor compounds 阿道尔克斯治疗有限公司 2025-03-07 CN disclosed
WO-2023233130-A1 CD73 INHIBITOR COMPOUNDS AdoRx Therapeutics Limited (GB) 2023-12-07 WO disclosed