SCHEMBL31542329

SCHEMBL31542329

Cc1cc2c(N3CCN(C)c4ccc(C#N)cc43)cc(C3CCN(CC4(O)CCN(C(=O)OC(C)(C)C)CC4)CC3)cc2n(C)c1=O

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 2/20 0.35
▸ NOTCH1 P46531 1/20 0.34
▸ HRH3 Q9Y5N1 4/20 0.34
▸ GPR119 Q8TDV5 6/20 0.33
▸ IRAK4 Q9NWZ3 1/20 0.32
▸ JAK1 P23458 2/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ JAK3 P52333 1/20 0.32
▸ PTK2 Q05397 1/20 0.32
▸ ADAM10 O14672 2/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ PRKDC P78527 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
SCHEMBL31542349 0.93 HRH3 (0.35) ALKNOTCH1HRH3GPR119IRAK4
SCHEMBL31542350 0.91 GPR119 (0.40) ALKNOTCH1GPR119IRAK4JAK2
SCHEMBL31542292 0.89 NOTCH1 (0.36) ALKNOTCH1GPR119IRAK4JAK2
SCHEMBL31542285 0.87 ALK (0.40) ALK
SCHEMBL31542299 0.80 ALK (0.33) ALK
SCHEMBL31542314 0.79 P2RY14 (0.39) HRH3GPR119
SCHEMBL31542332 0.79 EGLN2 (0.44) GPR119IRAK4
SCHEMBL31542301 0.78 GPR119 (0.41) HRH3GPR119JAK2
SCHEMBL31542311 0.78 GPR119 (0.40) HRH3GPR119
SCHEMBL31542334 0.78 KMT2A (0.38) GPR119PIK3CAPRKDC

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-2025062330-A1 HETEROCYCLIC COMPOUNDS AS CBP SELECTIVE DEGRADERS AURIGENE ONCOLOGY LIMITED (IN) 2025-03-27 — — WO disclosed
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