SCHEMBL24318078

SCHEMBL24318078

Nc1ncc(-c2ccccc2)cc1C(=O)NC1CCC(O)CC1

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BMPR1B O00238 18/20 0.77
▸ BMPR1A P36894 18/20 0.77
▸ ACVRL1 P37023 18/20 0.77
▸ ACVR1 Q04771 18/20 0.77
▸ TGFBR1 P36897 17/20 0.77
▸ PIK3C3 Q8NEB9 1/20 0.58
▸ ATR Q13535 1/20 0.58

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
SCHEMBL19806976 1.00 BMPR1B (0.77) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL19806938 0.89 BMPR1B (0.62) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL23940756 0.89 BMPR1B (0.62) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL19806887 0.89 BMPR1B (0.72) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL5712357 0.82 PIK3C3 (0.60) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL20995206 0.81 BMPR1B (0.74) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL20995207 0.81 BMPR1B (0.74) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL20995061 0.81 BMPR1B (1.00) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL19806989 0.81 BMPR1B (1.00) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL6838760 0.80 MERTK (0.60) 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
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
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