SCHEMBL16473260

SCHEMBL16473260

Cc1cc(-c2ncc(-c3ccc(NC=O)cc3)cc2-c2ccc3ncsc3c2)ccc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 6/20 0.49
▸ VRK1 Q99986 1/20 0.42
▸ AKT1 P31749 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ MTOR P42345 1/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ DYRK2 Q92630 3/20 0.36
▸ DYRK3 O43781 1/20 0.36
▸ CLK1 P49759 1/20 0.36
▸ CLK2 P49760 1/20 0.36
▸ DYRK1A Q13627 1/20 0.36
▸ CLK4 Q9HAZ1 1/20 0.36
▸ DYRK1B Q9Y463 1/20 0.36
▸ ADORA2A P29274 1/20 0.35
▸ PFKFB3 Q16875 5/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.34
▸ BMPR1A P36894 1/20 0.34
▸ SMAD2 Q15796 1/20 0.34

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
SCHEMBL16473258 0.91 TGFBR1 (0.48) TGFBR1VRK1AKT1PIK3CAMTOR
SCHEMBL15637457 0.82 TGFBR1 (0.50) TGFBR1VRK1DYRK2NPC1RAB9A
SCHEMBL19661542 0.81 TGFBR1 (0.49) TGFBR1VRK1AKT1PIK3CAMTOR
SCHEMBL16473264 0.80 TGFBR1 (0.46) TGFBR1VRK1AKT1PIK3CAMTOR
SCHEMBL15639414 0.80 TGFBR1 (0.52) TGFBR1VRK1MAPK14PFKFB3BMPR1A
SCHEMBL15638440 0.79 TGFBR1 (0.46) TGFBR1VRK1PIK3CANPC1RAB9A
SCHEMBL15637927 0.79 TGFBR1 (0.51) TGFBR1VRK1AKT1PIK3CAMTOR
SCHEMBL15637853 0.79 TGFBR1 (0.57) TGFBR1VRK1MAPK14CLK2DYRK1A
SCHEMBL15636907 0.77 CA12 (0.48) TGFBR1VRK1AKT1PIK3CAMTOR
SCHEMBL15638322 0.77 TGFBR1 (0.51) TGFBR1VRK1MAPK14DYRK2PFKFB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9878992-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2018-01-30 — — US disclosed
US-20170342048-A1 GDF-8 Inhibitors MIDCAP FINANCIAL TRUST 2017-11-30 — — US disclosed
US-9518040-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2016-12-13 — — US disclosed
US-9145433-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-09-29 — — US disclosed
US-20140107073-A1 GDF-8 Inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2014-04-17 — — US 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 (2 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-20140107073-A1 GDF-8 Inhibitors MSTN, MYOF, CXCL8 TGFBR1 128/4885VRK1 4678/4885AKT1 1115/4885
US-20170342048-A1 GDF-8 Inhibitors MSTN, MYOF, CXCL8 TGFBR1 128/4885VRK1 4678/4885AKT1 1115/4885

“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.

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