SCHEMBL23988758

SCHEMBL23988758

Cc1ccc(-c2cnc3c(-c4cccc5c(C(N)=O)cccc45)cnn3c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 15/20 0.57
BMPR1A P36894 8/20 0.57
BMPR1B O00238 7/20 0.57
ACVRL1 P37023 7/20 0.57
ACVR1B P36896 5/20 0.57
KDR P35968 4/20 0.53
BMP4 P12644 4/20 0.51
TGFBR1 P36897 2/20 0.47
TGFBR2 P37173 2/20 0.47
PRKAB1 Q9Y478 2/20 0.47
PARP1 P09874 1/20 0.46
BMPR2 Q13873 1/20 0.45

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
SCHEMBL23988701 0.94 ACVR1 (0.54) ACVR1BMPR1ABMPR1BACVRL1ACVR1B
SCHEMBL23988885 0.90 ACVR1 (0.56) ACVR1BMPR1ABMPR1BACVRL1ACVR1B
SCHEMBL23988805 0.90 KDR (0.54) ACVR1BMPR1ABMPR1BACVRL1ACVR1B
SCHEMBL23988739 0.89 ACVR1 (0.72) ACVR1BMPR1ABMPR1BACVRL1ACVR1B
SCHEMBL23988982 0.88 KDR (0.52) ACVR1BMPR1ABMPR1BACVRL1ACVR1B
SCHEMBL23988802 0.87 KDR (0.51) ACVR1BMPR1ABMPR1BACVRL1ACVR1B
SCHEMBL19110470 0.84 ACVR1 (0.68) ACVR1BMPR1ABMPR1BACVRL1ACVR1B
SCHEMBL23988794 0.83 KDR (0.54) ACVR1BMPR1ABMPR1BACVRL1ACVR1B
SCHEMBL19110482 0.83 ACVR1 (0.59) ACVR1BMPR1ABMPR1BACVRL1ACVR1B
SCHEMBL23988903 0.83 KDR (0.53) ACVR1BMPR1ABMPR1BACVRL1ACVR1B

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
WO-2023081212-A1 METHODS OF USING ALK2 INHIBITORS KEROS THERAPEUTICS, INC. (US) 2023-05-11 WO disclosed
WO-2021222875-A1 METHODS OF USING ALK2 INHIBITORS KEROS THERAPEUTICS, INC. (US) 2021-11-04 WO disclosed