SCHEMBL30768119

SCHEMBL30768119

CSc1ncc2cc(C(F)F)nc(N3CC4(CCN(C(=O)OC(C)(C)C)C4)C3)c2n1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 1/20 0.41
▸ ACACB O00763 5/20 0.39
▸ SCD5 Q86SK9 1/20 0.37
▸ PIK3R1 P27986 8/20 0.36
▸ PIK3CA P42336 8/20 0.36
▸ CCNA2 P20248 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ HDAC2 Q92769 2/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ EIF2AK4 Q9P2K8 1/20 0.35
▸ PIK3CD O00329 1/20 0.35
▸ PIK3CB P42338 1/20 0.35

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
SCHEMBL27035007 1.00 CYP11B2 (0.41) CYP11B2ACACBSCD5PIK3R1PIK3CA
SCHEMBL27034849 0.86 CYP11B2 (0.41) CYP11B2ACACBSCD5PIK3R1PIK3CA
SCHEMBL30768105 0.86 CYP11B2 (0.41) CYP11B2ACACBSCD5PIK3R1PIK3CA
SCHEMBL27059290 0.81 PDE9A (0.36) —
SCHEMBL27034828 0.79 CCNE1 (0.39) CYP11B2CCNA2CDK2
SCHEMBL30327698 0.74 CYP11B2 (0.46) CYP11B2ACACBSCD5PIK3R1PIK3CA
SCHEMBL20203405 0.72 MEN1 (0.40) —
SCHEMBL30328978 0.70 CYP11B2 (0.48) CYP11B2ACACBPIK3R1PIK3CACCNA2
SCHEMBL30328647 0.69 CYP11B2 (0.50) CYP11B2ACACBSCD5PIK3R1PIK3CA
SCHEMBL30328998 0.69 CYP11B2 (0.46) CYP11B2ACACBSCD5HDAC2HDAC1

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-4558502-A1 AZA-QUINAZOLINE COMPOUNDS AND METHODS OF USE Iambic Therapeutics, Inc. (US) 2025-05-28 — — EP disclosed
CN-120051470-A Azaquinazoline compounds and methods of use 依安彼克医疗有限公司 2025-05-27 — — CN disclosed
WO-2024020419-A1 AZA-QUINAZOLINE COMPOUNDS AND METHODS OF USE IAMBIC THERAPEUTICS, INC. (US) 2024-01-25 — — WO disclosed
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