SCHEMBL30203933

SCHEMBL30203933

Cc1cccc(-c2nc3n(c2-c2ccc4nccnc4c2)CCCN3)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 20/20 1.00
▸ MAPK14 Q16539 2/20 0.54
▸ MTOR P42345 1/20 0.47

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
SCHEMBL14576284 1.00 TGFBR1 (1.00) TGFBR1MAPK14MTOR
SCHEMBL30203968 0.94 TGFBR1 (1.00) TGFBR1MAPK14MTOR
SCHEMBL14576531 0.94 TGFBR1 (1.00) TGFBR1MAPK14MTOR
SCHEMBL14576260 0.90 TGFBR1 (0.89) TGFBR1MAPK14
SCHEMBL30204089 0.90 TGFBR1 (0.89) TGFBR1MAPK14
SCHEMBL14577024 0.83 TGFBR1 (1.00) TGFBR1MAPK14
SCHEMBL30203913 0.83 TGFBR1 (1.00) TGFBR1MAPK14
SCHEMBL21277970 0.82 TGFBR1 (0.70) TGFBR1MAPK14MTOR
SCHEMBL26664562 0.81 TGFBR1 (0.77) TGFBR1MAPK14MTOR
SCHEMBL26664554 0.81 TGFBR1 (0.77) TGFBR1MAPK14

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
CN-117999077-A Pharmaceutical composition for preventing or treating tumor and application thereof 株式会社蒂奥姆生物 2024-05-07 — — CN claimed
CN-117999077-A Pharmaceutical composition for preventing or treating tumor and application thereof 株式会社蒂奥姆生物 2024-05-07 — — CN disclosed
WO-2023008936-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING TUMOR, AND USE THEREOF 주식회사 티움바이오 2023-02-02 — — WO disclosed
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