SCHEMBL16475022

SCHEMBL16475022

Cn1cc(-c2cn(-c3ccc(OC(F)(F)F)cc3)c(=O)c3c2ccn3CCF)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 3/20 0.41
▸ CHRM5 P08912 1/20 0.41
▸ BRD4 O60885 1/20 0.40
▸ BCR P11274 1/20 0.38
▸ PDE3B Q13370 1/20 0.37
▸ PDE3A Q14432 1/20 0.37
▸ MCHR1 Q99705 3/20 0.36
▸ NPBWR1 P48145 2/20 0.36
▸ KDR P35968 1/20 0.36
▸ AURKB Q96GD4 1/20 0.36
▸ NTRK1 P04629 4/20 0.35
▸ NTRK2 Q16620 4/20 0.35
▸ KCNH2 Q12809 3/20 0.35
▸ NTRK3 Q16288 3/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TRPA1 O75762 1/20 0.35
▸ FGFR2 P21802 1/20 0.34
▸ FGFR3 P22607 1/20 0.34
▸ USP7 Q93009 1/20 0.34
▸ TDP2 O95551 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
SCHEMBL16474446 0.93 ABL1 (0.42) ABL1CHRM5BRD4BCRPDE3B
SCHEMBL16474983 0.93 ABL1 (0.42) ABL1CHRM5BRD4BCRPDE3B
SCHEMBL16475018 0.93 ABL1 (0.42) ABL1CHRM5BRD4BCRPDE3B
SCHEMBL16474442 0.89 ABL1 (0.44) ABL1CHRM5BRD4BCRPDE3B
SCHEMBL16474966 0.88 CHRM5 (0.43) ABL1CHRM5BRD4BCRMCHR1
SCHEMBL17151244 0.87 ABL1 (0.40) ABL1CHRM5BRD4BCRPDE3B
SCHEMBL16475063 0.86 ABL1 (0.42) ABL1CHRM5BRD4BCRPDE3B
SCHEMBL17151243 0.86 ABL1 (0.42) ABL1CHRM5BRD4BCRPDE3B
SCHEMBL16475023 0.85 ABL1 (0.37) ABL1BCRMCHR1NPBWR1TRPA1
SCHEMBL16475016 0.84 ABL1 (0.41) ABL1CHRM5BRD4BCRPDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2903991-B1 ANTI-FIBROTIC PYRIDINONES INTERMUNE INC (US) 2020-09-16 — — EP disclosed
US-10544161-B2 Anti-fibrotic pyridinones INTERMUNE, INC. (US) 2020-01-28 — — US disclosed
US-20190321343-A1 Anti-Fibrotic Pyridinones GENENTECH, INC. 2019-10-24 — — US disclosed
US-10376497-B2 Anti-fibrotic pyridinones INTERMUNE, INC. (US) 2019-08-13 — — US disclosed
US-20190144467-A1 ANTI-FIBROTIC PYRIDINONES GENENTECH, INC. 2019-05-16 — — US disclosed
US-10233195-B2 Anti-fibrotic pyridinones INTERMUNE, INC. (US) 2019-03-19 — — US disclosed
US-20180064692-A1 Anti-Fibrotic Pyridinones GENENTECH, INC. 2018-03-08 — — US disclosed
US-20180064692-A1 Anti-Fibrotic Pyridinones GENENTECH, INC. 2018-03-08 — — US disclosed
US-9675593-B2 Anti-fibrotic pyridinones INTERMUNE, INC. (US) 2017-06-13 — — US disclosed
US-9675593-B2 Anti-fibrotic pyridinones INTERMUNE, INC. (US) 2017-06-13 — — US disclosed
US-20170121345-A1 ANTI-FIBROTIC PYRIDINONES GENENTECH, INC. 2017-05-04 — — US disclosed
US-20170121345-A1 ANTI-FIBROTIC PYRIDINONES GENENTECH, INC. 2017-05-04 — — US disclosed
US-20160263090-A1 ANTI-FIBROTIC PYRIDINONES GENENTECH, INC. 2016-09-15 — — US disclosed
US-20160263090-A1 ANTI-FIBROTIC PYRIDINONES GENENTECH, INC. 2016-09-15 — — US disclosed
US-9359379-B2 Anti-fibrotic pyridinones INTERMUNE, INC. (US) 2016-06-07 — — US disclosed
US-9359379-B2 Anti-fibrotic pyridinones INTERMUNE, INC. (US) 2016-06-07 — — US disclosed
WO-2015153683-A1 ANTI-FIBROTIC PYRIDINONES INTERMUNE, INC. (US) 2015-10-08 — — WO disclosed
US-20140107110-A1 ANTI-FIBROTIC PYRIDINONES GENENTECH, INC. 2014-04-17 — — US disclosed
US-20140107110-A1 ANTI-FIBROTIC PYRIDINONES GENENTECH, INC. 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 (9 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-20180064692-A1 Anti-Fibrotic Pyridinones MMP1, COL1A1, COL2A1 ABL1 3203/4885CHRM5 2350/4885BRD4 588/4885
US-10544161-B2 Anti-fibrotic pyridinones MMP1, COL1A1, COL2A1 ABL1 3203/4885CHRM5 2350/4885BRD4 588/4885
US-20190321343-A1 Anti-Fibrotic Pyridinones MMP1, COL1A1, COL2A1 ABL1 3203/4885CHRM5 2350/4885BRD4 588/4885
US-20140107110-A1 ANTI-FIBROTIC PYRIDINONES MMP1, COL1A1, COL2A1 ABL1 3203/4885CHRM5 2350/4885BRD4 588/4885
US-20160263090-A1 ANTI-FIBROTIC PYRIDINONES MMP1, COL1A1, COL2A1 ABL1 3203/4885CHRM5 2350/4885BRD4 588/4885
US-10233195-B2 Anti-fibrotic pyridinones MMP1, COL1A1, COL2A1 ABL1 3203/4885CHRM5 2350/4885BRD4 588/4885
US-10376497-B2 Anti-fibrotic pyridinones MMP1, COL1A1, COL2A1 ABL1 3203/4885CHRM5 2350/4885BRD4 588/4885
US-20170121345-A1 ANTI-FIBROTIC PYRIDINONES MMP1, COL1A1, COL2A1 ABL1 3203/4885CHRM5 2350/4885BRD4 588/4885
US-20190144467-A1 ANTI-FIBROTIC PYRIDINONES MMP1, COL1A1, COL2A1 ABL1 3203/4885CHRM5 2350/4885BRD4 588/4885

“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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