SCHEMBL30580810

SCHEMBL30580810

CCc1nc(-c2cccc(C)n2)c(Oc2ccnc(Nc3cccc(C(N)=O)c3)c2)s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 6/20 0.43
▸ ROCK1 Q13464 1/20 0.43
▸ MAPK14 Q16539 3/20 0.40
▸ IKBKB O14920 1/20 0.39
▸ MAPK13 O15264 1/20 0.39
▸ PRKD3 O94806 1/20 0.39
▸ MAP4K4 O95819 1/20 0.39
▸ EGFR P00533 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ FLT4 P35916 1/20 0.39
▸ KDR P35968 1/20 0.39
▸ FRK P42685 1/20 0.39
▸ MAPK8 P45983 1/20 0.39
▸ MAPK9 P45984 1/20 0.39
▸ CSNK1A1 P48729 1/20 0.39
▸ CSNK1D P48730 1/20 0.39
▸ CSNK1E P49674 1/20 0.39
▸ MAPK12 P53778 1/20 0.39
▸ CSNK1G2 P78368 1/20 0.39
▸ PTK6 Q13882 1/20 0.39

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
SCHEMBL26119367 1.00 TGFBR1 (0.43) TGFBR1ROCK1MAPK14IKBKBMAPK13
SCHEMBL30581008 0.93 MAPK14 (0.46) TGFBR1MAPK14IKBKBMAPK13PRKD3
SCHEMBL26119712 0.93 MAPK14 (0.46) TGFBR1MAPK14IKBKBMAPK13PRKD3
SCHEMBL26118897 0.93 MAPK14 (0.38) TGFBR1MAPK14IKBKBMAPK13PRKD3
SCHEMBL30580871 0.93 MAPK14 (0.38) TGFBR1MAPK14IKBKBMAPK13PRKD3
SCHEMBL26121656 0.91 TGFBR1 (0.38) TGFBR1MAPK14IKBKBMAPK13PRKD3
SCHEMBL31377941 0.91 TGFBR1 (0.42) TGFBR1MAPK14IKBKBMAPK13PRKD3
SCHEMBL26123842 0.91 TGFBR1 (0.42) TGFBR1MAPK14IKBKBMAPK13PRKD3
SCHEMBL30580771 0.90 RAF1 (0.41) TGFBR1MAPK14IKBKBMAPK13PRKD3
SCHEMBL26124644 0.90 RAF1 (0.41) TGFBR1MAPK14IKBKBMAPK13PRKD3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119255993-A Thiazole derivative compound and use thereof 奥托泰利克生物公司 2025-01-03 — — CN claimed
WO-2023182780-A1 THIAZOLE DERIVATIVE COMPOUND AND USES THEREOF 오토텔릭바이오 주식회사 2023-09-28 — — WO claimed
CN-119255993-A Thiazole derivative compound and use thereof 奥托泰利克生物公司 2025-01-03 — — CN disclosed
WO-2023182780-A1 THIAZOLE DERIVATIVE COMPOUND AND USES THEREOF 오토텔릭바이오 주식회사 2023-09-28 — — WO disclosed
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