SCHEMBL23217899

SCHEMBL23217899

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

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.56
MTOR P42345 1/20 0.56
MAPK14 Q16539 5/20 0.43
RIPK2 O43353 2/20 0.43
ACVR1B P36896 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
KDR P35968 1/20 0.36
PRKD1 Q15139 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
SCHEMBL24164432 0.86 TGFBR1 (0.47) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL23217906 0.85 TGFBR1 (0.46) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL23217944 0.84 TGFBR1 (0.48) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL24164908 0.82 TGFBR1 (0.47) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL24164469 0.82 TGFBR1 (0.44) TGFBR1MAPK14RIPK2ACVR1BKDR
SCHEMBL23217935 0.81 TGFBR1 (0.43) TGFBR1MAPK14RIPK2ACVR1BKDR
SCHEMBL23217896 0.81 TGFBR1 (0.55) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL23217908 0.81 TGFBR1 (0.43) TGFBR1MAPK14RIPK2ACVR1BKDR
SCHEMBL10000768 0.80 TGFBR1 (0.83) TGFBR1MTORMAPK14RIPK2ACVR1B
SCHEMBL31718274 0.80 TGFBR1 (0.83) 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 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