SCHEMBL23217977

SCHEMBL23217977

COC(OC)c1nc(-c2cccc(C)n2)c(-c2ccc3ncc(OCCNC(=O)OC(C)(C)C)nc3c2)[nH]1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 10/20 0.42
SUCNR1 Q9BXA5 5/20 0.35
MTOR P42345 1/20 0.35
RIPK2 O43353 1/20 0.33
KDR P35968 1/20 0.33
ACVR1B P36896 1/20 0.33
MAPK14 Q16539 1/20 0.33
BCHE P06276 1/20 0.33
CKS1B P61024 1/20 0.32
SKP1 P63208 1/20 0.32
SKP2 Q13309 1/20 0.32
PDPK1 O15530 1/20 0.32
ATM Q13315 1/20 0.32
IDO1 P14902 1/20 0.32

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
SCHEMBL23217944 0.88 TGFBR1 (0.48) TGFBR1SUCNR1MTORRIPK2KDR
SCHEMBL23217959 0.87 TGFBR1 (0.41) TGFBR1SUCNR1MTORRIPK2KDR
SCHEMBL23217937 0.83 TGFBR1 (0.38) TGFBR1RIPK2KDRACVR1BMAPK14
SCHEMBL23217990 0.82 SCN9A (0.40) TGFBR1RIPK2KDRACVR1BMAPK14
SCHEMBL23217955 0.81 TGFBR1 (0.41) TGFBR1MAPK14
SCHEMBL24164908 0.81 TGFBR1 (0.47) TGFBR1MTORRIPK2KDRACVR1B
SCHEMBL23217946 0.80 TGFBR1 (0.37) TGFBR1RIPK2KDRACVR1BMAPK14
SCHEMBL24164651 0.77 TGFBR1 (0.37) TGFBR1RIPK2KDRACVR1BMAPK14
SCHEMBL7550981 0.74 TGFBR1 (0.54) TGFBR1MTORRIPK2KDRACVR1B
SCHEMBL23217942 0.74 TGFBR1 (0.47) TGFBR1MTORRIPK2KDRACVR1B

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