SCHEMBL31095641

SCHEMBL31095641

COc1cc(-n2cnc(Nc3nc(Cl)nc4c3ccn4S(=O)(=O)c3ccc(C)cc3)c2)cc(OC)c1OC

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 20/20 0.77

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
SCHEMBL25210942 1.00 ACVR1 (0.77) ACVR1
SCHEMBL25201366 0.87 ACVR1 (0.68) ACVR1
SCHEMBL20590086 0.87 ACVR1 (1.00) ACVR1
SCHEMBL25513167 0.86 ACVR1 (0.58) ACVR1
SCHEMBL25516362 0.84 ACVR1 (0.81) ACVR1
SCHEMBL25195619 0.84 ACVR1 (0.56) ACVR1
SCHEMBL31095447 0.84 ACVR1 (0.56) ACVR1
SCHEMBL20589766 0.82 ACVR1 (0.77) ACVR1
SCHEMBL20588643 0.82 ACVR1 (0.77) ACVR1
SCHEMBL20588640 0.82 ACVR1 (0.77) ACVR1

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-119060060-A Imidazole-containing ALK2 kinase inhibitors 拜奥克里斯特制药公司 2024-12-03 CN disclosed
CN-110913855-B Imidazole-containing ALK2 kinase inhibitors 拜奥克里斯特制药公司 2024-09-03 CN disclosed