SCHEMBL30508323

SCHEMBL30508323

CN1CCC(n2cc3cc(-c4cnc(N)c(C(=O)NC56CCC(O)(CC5)CC6)c4)ccc3n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BMPR1B O00238 14/20 0.49
BMPR1A P36894 14/20 0.49
ACVRL1 P37023 14/20 0.49
ACVR1 Q04771 14/20 0.49
TGFBR1 P36897 13/20 0.49
AXL P30530 2/20 0.44
MERTK Q12866 2/20 0.44
DYRK1A Q13627 3/20 0.42
CLK2 P49760 2/20 0.42
CLK3 P49761 2/20 0.42
GSK3B P49841 1/20 0.41
MAP4K3 Q8IVH8 1/20 0.41

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
SCHEMBL30508341 0.91 BMPR1B (0.49) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL30508328 0.89 BMPR1B (0.61) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL30508410 0.88 BMPR1B (0.60) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL30508221 0.86 BMPR1B (0.52) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL30508295 0.86 BMPR1B (0.61) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL30508184 0.86 BMPR1B (0.61) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL30508299 0.86 BMPR1B (0.61) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL30508183 0.86 BMPR1B (0.61) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL30508377 0.79 BMPR1B (0.61) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL30508332 0.78 BMPR1B (0.51) BMPR1BBMPR1AACVRL1ACVR1TGFBR1

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-116478145-B ALK2 kinase inhibitors 杭州邦顺制药有限公司 2024-02-02 CN disclosed
CN-116478145-A ALK2 kinase inhibitors 杭州邦顺制药有限公司 2023-07-25 CN disclosed