SCHEMBL23217896

SCHEMBL23217896

Cc1cccc(-c2nc(C(C)(C)C)[nH]c2-c2ccc3ncc(C(O)CN)nc3c2)n1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 19/20 0.55
MTOR P42345 1/20 0.55
MAPK14 Q16539 6/20 0.42
RIPK2 O43353 2/20 0.42
ACVR1B P36896 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDR P35968 2/20 0.37
PRKD1 Q15139 2/20 0.33
PDGFRA P16234 1/20 0.33
FLT1 P17948 1/20 0.33
FLT4 P35916 1/20 0.33
BRS3 P32247 1/20 0.33

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
SCHEMBL23217942 0.84 TGFBR1 (0.47) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL23217899 0.81 TGFBR1 (0.56) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL23217951 0.80 TGFBR1 (0.40) TGFBR1MAPK14RIPK2ACVR1BKDR
SCHEMBL10000768 0.80 TGFBR1 (0.83) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL31718274 0.80 TGFBR1 (0.83) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL24164908 0.73 TGFBR1 (0.47) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL23217944 0.73 TGFBR1 (0.48) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL373474 0.71 TGFBR1 (1.00) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL29361209 0.71 TGFBR1 (1.00) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL20097949 0.70 TGFBR1 (0.53) TGFBR1MTORMAPK14RIPK2ACVR1B

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-2022006340-A1 ALK5 INHIBITORS, CONJUGATES, AND USES THEREOF SILVERBACK THERAPEUTICS, INC. (US) 2022-01-06 WO disclosed
WO-2021072330-A1 GALNAC-TGFBR1 INHIBITOR CONJUGATES FOR THE TREATMENT OF LIVER DISEASES SILVERBACK THERAPEUTICS, INC. (US) 2021-04-15 WO disclosed