SCHEMBL18005299

SCHEMBL18005299

Cc1nc(-c2ncccc2-c2ccc3c(cnn3COCC[Si](C)(C)C)c2)ccc1F

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 17/20 0.52
TGFBR2 P37173 1/20 0.43
ALOX5AP P20292 2/20 0.38
FEN1 P39748 2/20 0.38
DGAT1 O75907 1/20 0.37

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
SCHEMBL18005105 0.88 TGFBR1 (0.49) TGFBR1TGFBR2ALOX5APFEN1DGAT1
SCHEMBL18005344 0.84 TGFBR1 (0.52) TGFBR1ALOX5APFEN1
SCHEMBL18005280 0.79 DGAT1 (0.36) ALOX5APFEN1DGAT1
SCHEMBL5518025 0.73 TRPA1 (0.60) ALOX5APFEN1DGAT1
SCHEMBL759979 0.73 CYP11B2 (0.43) DGAT1
SCHEMBL31378467 0.73 PTPN11 (0.40) ALOX5AP
SCHEMBL15639541 0.72 GRIN2B (0.40) TGFBR1
SCHEMBL15639668 0.71 GRIN2B (0.45) TGFBR1
SCHEMBL15639544 0.71 GRIN2B (0.39) TGFBR1
SCHEMBL18005295 0.69 TGFBR1 (1.00) TGFBR1TGFBR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 249/4885TGFBR2 153/4885ALOX5AP 3476/4885

“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.