SCHEMBL15638757

SCHEMBL15638757

Fc1ccc(-c2ncccc2-c2ccc3[nH]ncc3c2)cc1C1CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 3/20 0.61
▸ TRPA1 O75762 12/20 0.53
▸ ROCK2 O75116 4/20 0.45
▸ PIM1 P11309 3/20 0.45
▸ AURKB Q96GD4 3/20 0.45
▸ DAPK3 O43293 2/20 0.45
▸ PRKCG P05129 2/20 0.45
▸ CDK1 P06493 2/20 0.45
▸ PRKACA P17612 2/20 0.45
▸ CDK2 P24941 2/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ AKT1 P31749 2/20 0.45
▸ AKT2 P31751 2/20 0.45
▸ CSNK1D P48730 2/20 0.45
▸ GSK3A P49840 2/20 0.45
▸ CSNK2A1 P68400 2/20 0.45
▸ CDK5 Q00535 2/20 0.45
▸ PRKCD Q05655 2/20 0.45
▸ STK3 Q13188 2/20 0.45
▸ ROCK1 Q13464 2/20 0.45

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
SCHEMBL15639988 0.85 TGFBR1 (0.70) TGFBR1TRPA1ROCK2PIM1DAPK3
SCHEMBL15640023 0.84 TGFBR1 (0.70) TGFBR1TRPA1ROCK2PIM1AURKB
SCHEMBL30117430 0.83 TGFBR1 (0.58) TGFBR1TRPA1ROCK2PIM1AURKB
SCHEMBL15639428 0.83 TGFBR1 (0.58) TGFBR1TRPA1ROCK2PIM1AURKB
SCHEMBL15639722 0.82 TGFBR1 (0.72) TGFBR1TRPA1ROCK2PIM1DAPK3
SCHEMBL28425052 0.81 TGFBR1 (0.71) TGFBR1TRPA1ROCK2PIM1DAPK3
SCHEMBL15638316 0.81 TGFBR1 (0.64) TGFBR1TRPA1ROCK2PIM1AURKB
SCHEMBL15639895 0.81 TGFBR1 (0.64) TGFBR1TRPA1TRPM8
SCHEMBL15639575 0.81 TGFBR1 (0.78) TGFBR1TRPA1CDK5DYRK1AGSK3B
SCHEMBL30117546 0.81 TGFBR1 (0.78) TGFBR1TRPA1CDK5DYRK1AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2903978-B1 GDF-8 INHIBITORS RIGEL PHARMACEUTICALS INC (US) 2022-12-07 — — EP claimed
CN-104837832-B GDF-8 inhibitors 里格尔药品股份有限公司 2019-04-26 — — CN claimed
EP-2903978-A1 GDF-8 INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2015-08-12 — — EP claimed
CN-104837832-A GDF-8 inhibitors RIGEL PHARMACEUTICALS INC 2015-08-12 — — CN claimed
US-20140107073-A1 GDF-8 Inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2014-04-17 — — US claimed
WO-2014055955-A1 GDF-8 INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2014-04-10 — — WO claimed
EP-2903978-B1 GDF-8 INHIBITORS RIGEL PHARMACEUTICALS INC (US) 2022-12-07 — — EP disclosed
US-10858335-B2 2,3-Disubstituted pyridine compounds as TGF-β inhibitors and methods of use RIGEL PHARMACEUTICALS, INC. (US) 2020-12-08 — — US disclosed
US-10858335-B2 2,3-Disubstituted pyridine compounds as TGF-β inhibitors and methods of use RIGEL PHARMACEUTICALS, INC. (US) 2020-12-08 — — US disclosed
CN-106536507-B 2, 3-disubstituted pyridine compounds as TGF- β inhibitors and methods of use thereof 里格尔药品股份有限公司 2020-04-07 — — CN disclosed
US-20190284155-A1 2,3-Disubstituted Pyridine Compounds as TGF-Beta Inhibitors and Methods of Use RIGEL PHARMACEUTICALS, INC. (US) 2019-09-19 — — US disclosed
US-20190284155-A1 2,3-Disubstituted Pyridine Compounds as TGF-Beta Inhibitors and Methods of Use RIGEL PHARMACEUTICALS, INC. (US) 2019-09-19 — — US disclosed
CN-104837832-B GDF-8 inhibitors 里格尔药品股份有限公司 2019-04-26 — — CN disclosed
US-9145433-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-09-29 — — US disclosed
US-9145433-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-09-29 — — US disclosed
EP-2903978-A1 GDF-8 INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2015-08-12 — — EP disclosed
CN-104837832-A GDF-8 inhibitors RIGEL PHARMACEUTICALS INC 2015-08-12 — — CN disclosed
US-20140107073-A1 GDF-8 Inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2014-04-17 — — US disclosed
US-20140107073-A1 GDF-8 Inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2014-04-17 — — US disclosed
WO-2014055955-A1 GDF-8 INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2014-04-10 — — 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 (3 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 128/4885TRPA1 4474/4885ROCK2 500/4885
US-10858335-B2 2,3-Disubstituted pyridine compounds as TGF-β inhibitors and methods of use SMAD3, TGFBR1, TGFBR2 TGFBR1 2/4885TRPA1 4082/4885ROCK2 202/4885
US-20190284155-A1 2,3-Disubstituted Pyridine Compounds as TGF-Beta Inhibitors and Methods of Use TGFBR2, ACVR1, TGFBR1 TGFBR1 3/4885TRPA1 4202/4885ROCK2 267/4885

“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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