SCHEMBL18005478

SCHEMBL18005478

CC(=O)Nc1cn2cc(-c3cccnc3Cl)ccc2n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.67
BRAF P15056 6/20 0.53
MAPK13 O15264 5/20 0.53
KDR P35968 5/20 0.53
MAPK12 P53778 5/20 0.53
MAPK11 Q15759 5/20 0.53
MAPK14 Q16539 5/20 0.53
PIK3CA P42336 7/20 0.50
AKT1 P31749 1/20 0.49
MTOR P42345 1/20 0.49
LRRK2 Q5S007 3/20 0.49
PIK3CD O00329 1/20 0.49
PIK3CB P42338 1/20 0.49
PIK3CG P48736 1/20 0.49
PIK3C3 Q8NEB9 1/20 0.49
PI4KB Q9UBF8 1/20 0.49
ABL1 P00519 1/20 0.48
LYN P07948 1/20 0.46
KIT P10721 1/20 0.46
PDGFRA P16234 1/20 0.46

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
SCHEMBL18069413 0.82 TGFBR1 (0.53) TGFBR1
SCHEMBL29833474 0.81 TGFBR1 (1.00) TGFBR1BRAFMAPK13KDRMAPK12
SCHEMBL18005294 0.81 TGFBR1 (1.00) TGFBR1BRAFMAPK13KDRMAPK12
SCHEMBL29833468 0.78 TGFBR1 (1.00) TGFBR1BRAFMAPK13KDRMAPK12
SCHEMBL18005137 0.78 TGFBR1 (1.00) TGFBR1BRAFMAPK13KDRMAPK12
SCHEMBL2950612 0.78 PIK3CA (0.56) TGFBR1BRAFMAPK13KDRMAPK12
SCHEMBL15638469 0.77 PTK2 (0.56) MTORPIK3CDPIK3CGPIK3C3
SCHEMBL15639561 0.77 TGFBR1 (0.47) TGFBR1
SCHEMBL22380055 0.77 LRRK2 (0.77) TGFBR1BRAFMAPK13KDRMAPK12
SCHEMBL29537871 0.77 LRRK2 (0.77) TGFBR1BRAFMAPK13KDRMAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3259264-B1 GDF-8 INHIBITORS RIGEL PHARMACEUTICALS INC (US) 2022-07-27 EP disclosed
US-9981944-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC (US) 2018-05-29 US disclosed
US-9981944-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC (US) 2018-05-29 US disclosed
US-9981944-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC (US) 2018-05-29 US disclosed
EP-3259264-A1 GDF-8 INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2017-12-27 EP disclosed
US-20160264553-A1 GDF-8 Inhibitors MIDCAP FINANCIAL TRUST 2016-09-15 US disclosed
US-20160264553-A1 GDF-8 Inhibitors MIDCAP FINANCIAL TRUST 2016-09-15 US disclosed
US-20160264553-A1 GDF-8 Inhibitors MIDCAP FINANCIAL TRUST 2016-09-15 US disclosed
WO-2016133838-A1 GDF-8 INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2016-08-25 WO disclosed
WO-2016133838-A1 GDF-8 INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2016-08-25 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 (1 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-20160264553-A1 GDF-8 Inhibitors CXCL8, MSTN, LGALS8 TGFBR1 249/4885BRAF 2283/4885MAPK13 1805/4885

“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.