SCHEMBL373314

SCHEMBL373314

Cc1cccc(-c2nn3c(c2-c2ccnc4ccccc24)CCC3)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 1.00
THRB P10828 11/20 1.00
MAPK14 Q16539 10/20 1.00
GAK O14976 1/20 0.71
RIPK2 O43353 1/20 0.71
MAP4K4 O95819 1/20 0.71
KDR P35968 1/20 0.71
ACVR1B P36896 1/20 0.71
TGFBR2 P37173 1/20 0.71
CSNK1A1 P48729 1/20 0.71
CSNK1D P48730 1/20 0.71
CSNK1E P49674 1/20 0.71
TGFB2 P61812 1/20 0.71
MINK1 Q8N4C8 1/20 0.71
COQ8A Q8NI60 1/20 0.71
TNIK Q9UKE5 1/20 0.71
RIPK3 Q9Y572 1/20 0.71

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
SCHEMBL29740016 1.00 TGFBR1 (1.00) TGFBR1THRBMAPK14GAKRIPK2
SCHEMBL409533 0.92 TGFBR1 (0.85) TGFBR1THRBMAPK14GAKRIPK2
SCHEMBL12922146 0.89 TGFBR1 (0.82) TGFBR1THRBMAPK14GAKRIPK2
SCHEMBL413994 0.88 TGFBR1 (0.78) TGFBR1THRBMAPK14GAKRIPK2
SCHEMBL409351 0.88 TGFBR1 (0.78) TGFBR1THRBMAPK14GAKRIPK2
SCHEMBL413726 0.88 TGFBR1 (0.78) TGFBR1THRBMAPK14GAKRIPK2
SCHEMBL5232917 0.88 TGFBR1 (0.78) TGFBR1THRBMAPK14GAKRIPK2
SCHEMBL23852042 0.87 TGFBR1 (0.80) TGFBR1THRBMAPK14GAKRIPK2
SCHEMBL1027982 0.87 TGFBR1 (0.80) TGFBR1THRBMAPK14GAKRIPK2
SCHEMBL373523 0.87 TGFBR1 (1.00) TGFBR1THRBMAPK14GAKRIPK2

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1397364-B1 NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS LILLY CO ELI (US) 2007-07-25 EP claimed
CN-1269820-C Novel pyrrole derivatives as medicaments LILLY CO ELI (US) 2006-08-16 CN claimed
CN-1511157-A Novel pyrrole derivatives as medicaments 2004-07-07 CN claimed
US-20040106604-A1 Novel pyrrole derivatives as pharmaceutical agents ELI LILLY AND COMPANY 2004-06-03 US claimed
EP-1397364-A1 NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS ELI LILLY AND COMPANY (US) 2004-03-17 EP claimed
WO-2002094833-A1 NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS ELI LILLY AND COMPANY (US) 2002-11-28 WO claimed
US-11987558-B1 ALK5 inhibitors and their uses SYNTHIS THERAPEUTICS, INC. (US) 2024-05-21 US disclosed
US-20240053327-A1 NEURAL STEM CELL-INDUCED DIFFERENTIAL MEDIUM AND INDUCTION DIFFERENTIATION METHOD IREGENE THERAPEUTICS LTD (CN) 2024-02-15 US disclosed
US-20230321076-A1 APPLICATION OF TGF-B INHIBITOR IN INDUCING NEURAL STEM CELLS AND ORGANOID FORMATION IREGENE THERAPEUTICS LTD (CN) 2023-10-12 US disclosed
US-20230132568-A1 ANTIBODY-ALK5 INHIBITOR CONJUGATES AND THEIR USES SYNTHIS THERAPEUTICS, INC. (US) 2023-05-04 US disclosed
US-20230090552-A1 ALK5 INHIBITOR CONJUGATES AND USES THEREOF SYNTHIS THERAPEUTICS, INC. (US) 2023-03-23 US disclosed
US-11583593-B2 Antibody-ALK5 inhibitor conjugates and their uses SYNTHIS THERAPEUTICS, INC. (US) 2023-02-21 US disclosed
US-20220249680-A1 ANTIBODY-ALK5 INHIBITOR CONJUGATES AND THEIR USES SYNTHIS THERAPEUTICS, INC. (US) 2022-08-11 US disclosed
CN-1951939-A Novel pyrrole derivatives as pharmaceutical agents LILLY CO ELI (US) 2007-04-25 CN disclosed
CN-1269820-C Novel pyrrole derivatives as medicaments LILLY CO ELI (US) 2006-08-16 CN disclosed
US-7087626-B2 Pyrrole derivatives as pharmaceutical agents ELI LILLY AND COMPANY (US) 2006-08-08 US disclosed
CN-1511157-A Novel pyrrole derivatives as medicaments 2004-07-07 CN disclosed
US-20040106604-A1 Novel pyrrole derivatives as pharmaceutical agents ELI LILLY AND COMPANY 2004-06-03 US disclosed
EP-1397364-A1 NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS ELI LILLY AND COMPANY (US) 2004-03-17 EP disclosed
WO-2002094833-A1 NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS ELI LILLY AND COMPANY (US) 2002-11-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11987558-B1 ALK5 inhibitors and their uses ALK, ALKBH3, ALKBH5 TGFBR1 106/4885THRB 892/4885MAPK14 1923/4885
US-20220249680-A1 ANTIBODY-ALK5 INHIBITOR CONJUGATES AND THEIR USES ALK, ALKBH5, ALKBH3 TGFBR1 528/4885THRB 1981/4885MAPK14 2643/4885
US-20230090552-A1 ALK5 INHIBITOR CONJUGATES AND USES THEREOF ALK, ALKBH5, ALKBH3 TGFBR1 75/4885THRB 2718/4885MAPK14 1174/4885
US-11583593-B2 Antibody-ALK5 inhibitor conjugates and their uses ALK, ALKBH5, ALKBH3 TGFBR1 528/4885THRB 1981/4885MAPK14 2643/4885
US-20040106604-A1 Novel pyrrole derivatives as pharmaceutical agents TGFBR1, SMAD3, TGFBR2 TGFBR1 1/4885THRB 500/4885MAPK14 546/4885
US-20230132568-A1 ANTIBODY-ALK5 INHIBITOR CONJUGATES AND THEIR USES ALK, ALKBH5, ALKBH3 TGFBR1 528/4885THRB 1981/4885MAPK14 2643/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.