SCHEMBL4074669

SCHEMBL4074669

N#Cc1ccc(-c2nc(-c3ccccn3)c(-c3ccc4c(c3)OCO4)o2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 9/20 0.64
MAPK13 O15264 1/20 0.64
MAPK12 P53778 1/20 0.64
MAPK11 Q15759 1/20 0.64
MAPK14 Q16539 1/20 0.64
MAPT P10636 4/20 0.51
POLB P06746 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
TP53 P04637 1/20 0.51
PKM P14618 1/20 0.51
ESR2 Q92731 1/20 0.51
ACVR1B P36896 2/20 0.44
GSK3A P49840 2/20 0.44
GSK3B P49841 2/20 0.44
KDM4E B2RXH2 3/20 0.43
CSNK1E P49674 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43

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
SCHEMBL4076126 0.82 TGFBR1 (0.66) TGFBR1MAPK13MAPK12MAPK11MAPK14
SCHEMBL373802 0.78 TGFBR1 (1.00) TGFBR1MAPK13MAPK12MAPK11MAPK14
SCHEMBL29624091 0.75 TGFBR1 (0.61) TGFBR1MAPK13MAPK12MAPK11MAPK14
SCHEMBL4084260 0.75 TGFBR1 (0.61) TGFBR1MAPK13MAPK12MAPK11MAPK14
SCHEMBL13998757 0.75 TGFBR1 (0.75) TGFBR1MAPK13MAPK12MAPK11MAPK14
SCHEMBL13998763 0.74 TGFBR1 (0.73) TGFBR1MAPK13MAPK12MAPK11MAPK14
SCHEMBL13998770 0.73 TGFBR1 (0.71) TGFBR1MAPK13MAPK12MAPK11MAPK14
SCHEMBL4035328 0.73 MAPT (0.55) TGFBR1MAPK13MAPK12MAPK11MAPK14
SCHEMBL4569965 0.72 RAB9A (0.68) TGFBR1MAPK13MAPK12MAPK11MAPK14
SCHEMBL29496949 0.72 RAB9A (0.68) TGFBR1MAPK13MAPK12MAPK11MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099237-A1 Methods of treating inflammatory diseases ROCHE PALO ALTO LLC 2009-04-16 US claimed
WO-2009047163-A1 METHODS OF TREATING INFLAMMATORY DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2009-04-16 WO claimed
US-20080146617-A1 Methods of treating inflammatory diseases ROCHE PALO ALTO LLC 2008-06-19 US claimed
WO-2008071605-A2 METHODS OF TREATING INFLAMMATORY DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2008-06-19 WO claimed
US-20060194845-A1 Use of ALK 5 inhibitors to modulate or inhibit myostatin activity leading to increased lean tissue accretion in animals SCHERING CORPORATION 2006-08-31 US claimed
EP-1169317-B1 TRIARYLIMIDAZOLES SMITHKLINE BEECHAM CORP (US) 2003-01-15 EP claimed
JP-2002541253-A 2002-12-03 JP claimed
US-6465493-B1 SUCH AS 4-(4-(4-FLUOROPHENYL)-5-(2-PYRIDYL)-1-HYDROXY-1H-IMIDAZOL-2-YL)BENZONITRILE; ALK5 MEDIATED DISEASES SUCH AS ARTHRITIS, OSTEOPOROSIS, KIDNEY AND RENAL DISEASES, CONGES-TIVE HEART FAILURE, ULCERS, DIABETIC NEPHROPATHY SMITHKLINE BEECHAM CORPORATION 2002-10-15 US claimed
EP-1169317-A1 TRIARYLIMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 2002-01-09 EP claimed
WO-2000061576-A1 TRIARYLIMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 2000-10-19 WO claimed
US-20240084258-A1 METHOD FOR PREPARING BROWN ADIPOCYTE KYOTO PREFECTURAL PUBLIC UNIVERSITY CORPORATION (JP) 2024-03-14 US disclosed
EP-3133149-B1 METHOD FOR PREPARING OSTEOBLASTS AND OSTEOBLAST INDUCER KYOTO PREFECTURAL PUBLIC UNIV CORP (JP) 2022-06-22 EP disclosed
US-11174464-B2 Method for preparing osteoblasts and osteoblast inducer KYOTO PREFECTURAL PUBLIC UNIVERSITY CORPORATION (JP) 2021-11-16 US disclosed
US-20180355319-A1 METHOD FOR PREPARING BROWN ADIPOCYTE KYOTO PREFECTURAL PUBLIC UNIVERSITY CORPORATION (JP) 2018-12-13 US disclosed
CN-106459903-A Preparation method of osteoblast and osteoblast inducer 京都府公立大学法人 2017-02-22 CN disclosed
WO-2006025988-A1 USE OF ALK 5 INHIBITORS TO MODULATE OR INHIBIT MYOSTATIN ACTIVITY LEADING TO INCREASED LEAN TISSUE ACCRETION IN ANIMALS SCHERING-PLOUGH LTD. (CH) 2006-03-09 WO disclosed
EP-1169317-B1 TRIARYLIMIDAZOLES SMITHKLINE BEECHAM CORP (US) 2003-01-15 EP disclosed
US-6465493-B1 SUCH AS 4-(4-(4-FLUOROPHENYL)-5-(2-PYRIDYL)-1-HYDROXY-1H-IMIDAZOL-2-YL)BENZONITRILE; ALK5 MEDIATED DISEASES SUCH AS ARTHRITIS, OSTEOPOROSIS, KIDNEY AND RENAL DISEASES, CONGES-TIVE HEART FAILURE, ULCERS, DIABETIC NEPHROPATHY SMITHKLINE BEECHAM CORPORATION 2002-10-15 US disclosed
EP-1169317-A1 TRIARYLIMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 2002-01-09 EP disclosed
WO-2000061576-A1 TRIARYLIMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 2000-10-19 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 (5 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-20060194845-A1 Use of ALK 5 inhibitors to modulate or inhibit myostatin activity leading to increased lean tissue accretion in animals ALK, ACVR1, MSTN TGFBR1 56/4885MAPK13 1750/4885MAPK12 1902/4885
US-11174464-B2 Method for preparing osteoblasts and osteoblast inducer CKMT1A; CKMT1B, PACSIN2, SREBF1 TGFBR1 1614/4885MAPK13 956/4885MAPK12 1120/4885
US-20240084258-A1 METHOD FOR PREPARING BROWN ADIPOCYTE FABP4, MAPK1, MAP3K1 TGFBR1 304/4885MAPK13 50/4885MAPK12 44/4885
US-20090099237-A1 Methods of treating inflammatory diseases CSNK1A1, PACSIN2, CSNK1G1 TGFBR1 3096/4885MAPK13 793/4885MAPK12 1222/4885
US-20080146617-A1 Methods of treating inflammatory diseases CSNK1A1, PACSIN2, CSNK1G1 TGFBR1 3096/4885MAPK13 793/4885MAPK12 1222/4885

“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.