SCHEMBL24318151

SCHEMBL24318151

CC1CN(C2CCOCC2)CC1c1ccc(-c2cnc(N)c(C(=O)NC3CCCCC3)c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BMPR1B O00238 19/20 0.63
BMPR1A P36894 19/20 0.63
TGFBR1 P36897 19/20 0.63
ACVRL1 P37023 19/20 0.63
ACVR1 Q04771 19/20 0.63
PIK3C3 Q8NEB9 1/20 0.50

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
SCHEMBL21027200 0.93 BMPR1B (0.66) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL27407318 0.93 BMPR1B (0.66) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL21027488 0.93 BMPR1B (0.66) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL21026978 0.87 BMPR1B (0.69) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL21027936 0.85 BMPR1B (0.69) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL23418649 0.85 BMPR1B (0.60) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL19806891 0.85 BMPR1B (0.67) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL23418441 0.83 BMPR1B (0.68) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL21027223 0.82 BMPR1B (0.67) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL22456040 0.81 BMPR1B (0.68) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3971177-A1 AMINOPYRIDINE DERIVATIVES AND THEIR USE AS SELECTIVE ALK-2 INHIBITORS Novartis AG (CH) 2022-03-23 EP disclosed