SCHEMBL6684201

SCHEMBL6684201

Cc1cccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3ccccc3n2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 14/20 1.00
MAPK14 Q16539 1/20 0.61
ROCK2 O75116 6/20 0.60
ROCK1 Q13464 2/20 0.55
CLK2 P49760 1/20 0.54
BLK P51451 1/20 0.54
CSNK2A1 P68400 1/20 0.54
STK3 Q13188 1/20 0.54
DYRK1A Q13627 1/20 0.54
AURKB Q96GD4 1/20 0.54
CLK4 Q9HAZ1 1/20 0.54
STK17A Q9UEE5 1/20 0.54

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
SCHEMBL30814808 1.00 TGFBR1 (1.00) TGFBR1MAPK14ROCK2ROCK1CLK2
SCHEMBL6704579 0.88 TGFBR1 (0.79) TGFBR1MAPK14ROCK2
SCHEMBL18114567 0.86 TGFBR1 (0.76) TGFBR1MAPK14ROCK2
SCHEMBL29395013 0.83 TGFBR1 (0.71) TGFBR1ROCK2ROCK1CLK2BLK
SCHEMBL13154697 0.83 TGFBR1 (0.71) TGFBR1ROCK2ROCK1CLK2BLK
SCHEMBL3586914 0.83 TGFBR1 (0.71) TGFBR1ROCK2ROCK1CLK2BLK
SCHEMBL3113958 0.83 TGFBR1 (0.71) TGFBR1ROCK2ROCK1CLK2BLK
SCHEMBL3585107 0.82 TGFBR1 (0.69) TGFBR1ROCK2ROCK1CLK2BLK
SCHEMBL22201315 0.82 TGFBR1 (0.70) TGFBR1ROCK2ROCK1CLK2BLK
SCHEMBL3574349 0.82 TGFBR1 (0.69) TGFBR1ROCK2ROCK1CLK2BLK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240180920-A1 CERTAIN FASCIN BINDING COMPOUNDS FOR SPINOGENESIS SPINOGENIX INC (US) 2024-06-06 US disclosed
CN-117320713-A Certain fascin-binding compounds for dendritic spine production 斯皮诺吉尼克斯公司 2023-12-29 CN disclosed
US-20210254056-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION 2021-08-19 US disclosed
US-20160354375-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES SUCH AS TAUOPATHIES ELECTROPHORETICS LIMITED (GB) 2016-12-08 US disclosed
US-20140031547-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODE-GENERATIVE DISEASES SUCH AS TAUOPATHIES ELECTROPHORETICS LIMITED 2014-01-30 US disclosed
WO-2004065392-A1 CONDENSED PYRIDINES AND PYRIMIDINES AND THEIR USE AS ALK-5 RECEPTOR LIGANDS SMITHKLINE BEECHAM CORPORATION (US) 2004-08-05 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 (3 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-20240180920-A1 CERTAIN FASCIN BINDING COMPOUNDS FOR SPINOGENESIS NEFM, FSCN1, STMN1 TGFBR1 4184/4885MAPK14 1175/4885ROCK2 1171/4885
US-20140031547-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODE-GENERATIVE DISEASES SUCH AS TAUOPATHIES CSNK1G1, CSNK1A1, CSNK1G3 TGFBR1 2376/4885MAPK14 871/4885ROCK2 712/4885
US-20160354375-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES SUCH AS TAUOPATHIES CSNK1G1, CSNK1A1, CSNK1D TGFBR1 3476/4885MAPK14 636/4885ROCK2 991/4885

“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.