SCHEMBL23217944

SCHEMBL23217944

Cc1cccc(-c2nc(C(C)(C)C)[nH]c2-c2ccc3ncc(OCCNC(=O)OC(C)(C)C)nc3c2)n1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 13/20 0.48
MTOR P42345 1/20 0.48
MAPK14 Q16539 3/20 0.38
RIPK2 O43353 2/20 0.38
ACVR1B P36896 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
SUCNR1 Q9BXA5 5/20 0.35
KDR P35968 1/20 0.35
BCHE P06276 1/20 0.34
CKS1B P61024 1/20 0.34
SKP1 P63208 1/20 0.34
SKP2 Q13309 1/20 0.34

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
SCHEMBL24164908 0.91 TGFBR1 (0.47) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL23217959 0.89 TGFBR1 (0.41) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL23217977 0.88 TGFBR1 (0.42) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL23217937 0.85 TGFBR1 (0.38) TGFBR1MAPK14RIPK2ACVR1BKDR
SCHEMBL23217990 0.84 SCN9A (0.40) TGFBR1MAPK14RIPK2ACVR1BKDR
SCHEMBL23217942 0.84 TGFBR1 (0.47) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL23217899 0.84 TGFBR1 (0.56) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL23217955 0.83 TGFBR1 (0.41) TGFBR1MAPK14
SCHEMBL23217946 0.82 TGFBR1 (0.37) TGFBR1MAPK14RIPK2ACVR1BKDR
SCHEMBL24164651 0.79 TGFBR1 (0.37) TGFBR1MAPK14RIPK2ACVR1BKDR

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 3 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-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