SCHEMBL19806995

SCHEMBL19806995

Nc1ncc(-c2ccc(C3CCNC3)cc2)cc1C(=O)NC1CCCCC1

nearest known ligand 0.85

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BMPR1B O00238 17/20 0.85
▸ BMPR1A P36894 17/20 0.85
▸ ACVRL1 P37023 17/20 0.85
▸ ACVR1 Q04771 17/20 0.85
▸ TGFBR1 P36897 16/20 0.85
▸ PIK3C3 Q8NEB9 2/20 0.51

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
SCHEMBL19806989 0.92 BMPR1B (1.00) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL20995061 0.92 BMPR1B (1.00) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL19806887 0.81 BMPR1B (0.72) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL20995196 0.81 BMPR1B (0.71) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL29373251 0.81 BMPR1B (0.71) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL19806883 0.79 BMPR1B (0.86) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL23940672 0.78 BMPR1B (0.62) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL19806965 0.78 BMPR1B (0.62) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL23940691 0.78 BMPR1B (0.61) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL19807000 0.78 BMPR1B (1.00) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3971177-B1 AMINOPYRIDINE DERIVATIVES AND THEIR USE AS SELECTIVE ALK-2 INHIBITORS NOVARTIS AG (CH) 2024-06-26 — — EP disclosed
EP-3971177-A1 AMINOPYRIDINE DERIVATIVES AND THEIR USE AS SELECTIVE ALK-2 INHIBITORS Novartis AG (CH) 2022-03-23 — — EP disclosed
EP-3487851-B1 AMINOPYRIDINE DERIVATIVES AND THEIR USE AS SELECTIVE ALK-2 INHIBITORS NOVARTIS AG (CH) 2021-10-20 — — EP disclosed
WO-2018014829-A1 AMINOPYRIDINE DERIVATIVES AND THEIR USE AS SELECTIVE ALK-2 INHIBITORS NOVARTIS AG (CH) 2018-01-25 — — WO disclosed
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