SCHEMBL31601723

SCHEMBL31601723

CC#Cc1cnc2c(N(CC(=O)Nc3c(N)ccc(F)c3F)Cc3ccc(OC)cc3)cc(N3CCOCC3)nn12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ WNT3A P56704 1/20 0.36
▸ MAPT P10636 4/20 0.34
▸ GAA P10253 2/20 0.34
▸ THRB P10828 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ DGAT1 O75907 1/20 0.34
▸ SOAT1 P35610 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ CSF1R P07333 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PDE1B Q01064 4/20 0.32
▸ KIT P10721 1/20 0.32
▸ AKT1 P31749 1/20 0.32
▸ PIK3CD O00329 1/20 0.31
▸ PIK3C2B O00750 1/20 0.31
▸ MTOR P42345 1/20 0.31
▸ PIK3CG P48736 1/20 0.31
▸ LCK P06239 1/20 0.31
▸ JAK3 P52333 1/20 0.31

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
SCHEMBL31601900 0.89 AKT1 (0.35) WNT3AMAPTGAATHRBLMNA
SCHEMBL31601961 0.89 THRB (0.36) WNT3AMAPTGAATHRBLMNA
SCHEMBL31601903 0.85 HDAC1 (0.32) MAPTLMNA
SCHEMBL31601789 0.84 DGAT1 (0.40) WNT3AMAPTGAATHRBDGAT1
SCHEMBL31601913 0.81 HDAC2 (0.35) MAPTGAALMNAALDH1A1
SCHEMBL31601881 0.81 MEN1 (0.33) MAPTGAAALDH1A1
SCHEMBL31601832 0.81 PDE1B (0.36) WNT3AMAPTGAATHRBDGAT1
SCHEMBL31601775 0.78 HDAC3 (0.31) —
SCHEMBL31601923 0.76 THRB (0.38) WNT3AMAPTGAATHRBDGAT1
SCHEMBL31601860 0.75 ALDH1A1 (0.37) WNT3AMAPTGAATHRBLMNA

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
WO-2025110815-A1 IMIDAZO [1,2-B] PYRIDAZINE-BASED NOVEL COMPOUND AS CDK INHIBITOR AND USE THEREOF 아이리드비엠에스 주식회사 2025-05-30 — — WO disclosed
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