SCHEMBL24409686

SCHEMBL24409686

FC(F)(F)c1cccc(-c2cnn3cc(-c4ccc(N5CCNCC5)cc4)cnc23)c1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 16/20 0.72
TGFBR1 P36897 5/20 0.72
KDR P35968 4/20 0.72
PRKAB1 Q9Y478 4/20 0.72
BMPR1B O00238 13/20 0.63
ACVRL1 P37023 13/20 0.63
BMPR1A P36894 12/20 0.63
ACVR1B P36896 9/20 0.63
TGFBR2 P37173 3/20 0.63
BMPR2 Q13873 3/20 0.63
BMP4 P12644 3/20 0.58
RIPK2 O43353 1/20 0.58
ACVR2A P27037 1/20 0.58
ACVR2B Q13705 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
SCHEMBL24409638 0.89 ACVR1 (0.70) ACVR1TGFBR1KDRPRKAB1BMPR1B
SCHEMBL24409622 0.85 ACVR1 (0.77) ACVR1TGFBR1KDRPRKAB1BMPR1B
SCHEMBL15996329 0.84 ACVR1 (1.00) ACVR1TGFBR1KDRPRKAB1BMPR1B
SCHEMBL24409640 0.83 ACVR1 (0.60) ACVR1TGFBR1KDRPRKAB1BMPR1B
SCHEMBL24409797 0.83 ACVR1 (0.74) ACVR1TGFBR1KDRPRKAB1BMPR1B
SCHEMBL24409652 0.82 ACVR1 (0.76) ACVR1TGFBR1KDRPRKAB1BMPR1B
SCHEMBL17441841 0.82 ACVR1 (0.69) ACVR1TGFBR1KDRPRKAB1BMPR1B
SCHEMBL24409696 0.82 ACVR1 (0.71) ACVR1TGFBR1KDRPRKAB1BMPR1B
SCHEMBL24409669 0.81 ACVR1 (0.62) ACVR1TGFBR1KDRPRKAB1BMPR1B
SCHEMBL24409635 0.81 ACVR1 (0.70) ACVR1TGFBR1KDRPRKAB1BMPR1B

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
WO-2023081212-A1 METHODS OF USING ALK2 INHIBITORS KEROS THERAPEUTICS, INC. (US) 2023-05-11 WO disclosed
WO-2022098821-A1 METHODS OF TREATING LYMPHOPENIA KEROS THERAPEUTICS, INC. (US) 2022-05-12 WO disclosed
WO-2022099166-A1 METHODS OF TREATING CARDIOVASCULAR-RELATED DISEASE KEROS THERAPEUTICS, INC. (US) 2022-05-12 WO disclosed
WO-2022098812-A1 METHODS OF TREATING IRON OVERLOAD KEROS THERAPEUTICS, INC. (US) 2022-05-12 WO disclosed