SCHEMBL18005158

SCHEMBL18005158

Cc1nc(-c2ncccc2-c2ccc3[nH]ncc3c2)ccc1F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 11/20 1.00
TRPA1 O75762 9/20 0.55
TGFBR2 P37173 1/20 0.49
TRPM8 Q7Z2W7 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
SCHEMBL15639722 0.84 TGFBR1 (0.72) TGFBR1TRPA1TRPM8
SCHEMBL28425052 0.83 TGFBR1 (0.71) TGFBR1TRPA1TRPM8
SCHEMBL15640012 0.83 TGFBR1 (0.71) TGFBR1TRPA1TRPM8
SCHEMBL18005225 0.83 TGFBR1 (1.00) TGFBR1TRPA1TGFBR2TRPM8
SCHEMBL15640134 0.83 TGFBR1 (0.72) TGFBR1TRPA1
SCHEMBL15639988 0.82 TGFBR1 (0.70) TGFBR1TRPA1TRPM8
SCHEMBL15640010 0.82 TGFBR1 (0.69) TGFBR1TRPA1TRPM8
SCHEMBL15730107 0.82 TGFBR1 (0.68) TGFBR1TRPA1TRPM8
SCHEMBL15639540 0.81 TRPA1 (0.75) TGFBR1TRPA1TRPM8
SCHEMBL15639442 0.81 TGFBR1 (0.68) TGFBR1TRPA1TRPM8

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 11 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 claimed
EP-3259264-A1 GDF-8 INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2017-12-27 EP claimed
US-20160264553-A1 GDF-8 Inhibitors MIDCAP FINANCIAL TRUST 2016-09-15 US claimed
WO-2016133838-A1 GDF-8 INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2016-08-25 WO claimed
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
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 249/4885TRPA1 1052/4885TGFBR2 153/4885

“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.