SCHEMBL1366357

SCHEMBL1366357

Cc1cc(CO)c2ccccc2n1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.62
▸ NCF1 P14598 3/20 0.58
▸ CYP2C19 P33261 1/20 0.57
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ HTT P42858 3/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ GALR3 O60755 1/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49

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
SCHEMBL6788358 0.87 CYP2C19 (0.56) CYP1A2NCF1CYP2C19SMN1; SMN2HTT
SCHEMBL8232676 0.84 CYP1A2 (0.62) CYP1A2NCF1CYP2C19SMN1; SMN2HTT
SCHEMBL6784056 0.83 CYP1A2 (0.56) CYP1A2NCF1CYP2C19SMN1; SMN2HTT
SCHEMBL3881739 0.83 LMNA (0.56) CYP1A2NCF1CYP2C19SMN1; SMN2HTT
SCHEMBL994597 0.82 CYP1A2 (0.60) CYP1A2NCF1CYP2C19SMN1; SMN2HTT
SCHEMBL3921968 0.82 CYP1A2 (0.60) CYP1A2NCF1CYP2C19SMN1; SMN2HTT
SCHEMBL6494917 0.82 CYP1A2 (0.60) CYP1A2NCF1CYP2C19SMN1; SMN2HTT
SCHEMBL6494921 0.82 CYP1A2 (0.60) CYP1A2NCF1CYP2C19SMN1; SMN2HTT
SCHEMBL265139 0.82 NCF1 (0.61) CYP1A2NCF1CYP2C19SMN1; SMN2HTT
SCHEMBL6985541 0.82 CYP1A2 (0.60) CYP1A2NCF1CYP2C19SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109776407-B Preparation method of 2-methyl-4-hydroxymethyl quinoline and derivatives thereof 济南大学 2022-04-12 — — CN claimed
CN-109776407-A A kind of preparation method of 2- methyl -4- hydroxymethyl quinoline and its derivative 济南大学 2019-05-21 — — CN claimed
US-6620823-B2 Antiinflammatory agents; rheumatic disorders BRISTOL-MYERS SQUIBB PHARME COMPANY 2003-09-16 — — US claimed
CN-109776407-B Preparation method of 2-methyl-4-hydroxymethyl quinoline and derivatives thereof 济南大学 2022-04-12 — — CN disclosed
CN-109776407-B Preparation method of 2-methyl-4-hydroxymethyl quinoline and derivatives thereof 济南大学 2022-04-12 — — CN disclosed
CN-109467549-B Quinoline-substituted chalcone compound, preparation method and application thereof 中国药科大学 2021-02-09 — — CN disclosed
CN-109776407-A A kind of preparation method of 2- methyl -4- hydroxymethyl quinoline and its derivative 济南大学 2019-05-21 — — CN disclosed
CN-109776407-A A kind of preparation method of 2- methyl -4- hydroxymethyl quinoline and its derivative 济南大学 2019-05-21 — — CN disclosed
CN-109467549-A Quinoline replaces chalcone compounds, preparation method and the usage 中国药科大学 2019-03-15 — — CN disclosed
US-10226459-B2 Aza spiro alkane derivatives as inhibitors of metalloproteases INCYTE HOLDINGS CORPORATION (US) 2019-03-12 — — US disclosed
US-20180153882-A1 AZA Spiro Alkane Derivatives as Inhibitors of Metalloproteases INCYTE CORPORATION 2018-06-07 — — US disclosed
WO-2001070734-A2 BETA-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEASES AND TNF-ALPHA BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-09-27 — — WO disclosed
EP-1087937-A1 CYCLIC HYDROXAMIC ACIDS AS METALLOPROTEINASE INHIBITORS Du Pont Pharmaceuticals Company (US) 2001-04-04 — — EP disclosed
EP-1054877-A1 NOVEL CYCLIC SULFONAMIDE DERIVATIVES AS METALLOPROTEINASE INHIBITORS Du Pont Pharmaceuticals Company (US) 2000-11-29 — — EP disclosed
WO-2000059285-A2 NOVEL LACTAM INHIBITORS OF MATRIX METALLOPROTEINASES, TNF-α, AND AGGRECANASE DU PONT PHARMACEUTICALS COMPANY (US) 2000-10-12 — — WO disclosed
EP-1027332-A1 NOVEL LACTAM METALLOPROTEASE INHIBITORS Du Pont Pharmaceuticals Company (US) 2000-08-16 — — EP disclosed
US-6057336-A ANTIINFLAMMATORY AGENTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-05-02 — — US disclosed
WO-1999065867-A1 CYCLIC HYDROXAMIC ACIDS AS METALLOPROTEINASE INHIBITORS DU PONT PHARMACEUTICALS COMPANY (US) 1999-12-23 — — WO disclosed
WO-1999041246-A1 NOVEL CYCLIC SULFONAMIDE DERIVATIVES AS METALLOPROTEINASE INHIBITORS DU PONT PHARMACEUTICALS COMPANY (US) 1999-08-19 — — WO disclosed
WO-1999018074-A1 NOVEL LACTAM METALLOPROTEASE INHIBITORS Britol-Myers Squibb Pharma Company (US) 1999-04-15 — — 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 (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-10226459-B2 Aza spiro alkane derivatives as inhibitors of metalloproteases MMP9, MMP3, MMP12 CYP1A2 173/4885NCF1 1966/4885CYP2C19 349/4885
US-20180153882-A1 AZA Spiro Alkane Derivatives as Inhibitors of Metalloproteases MMP9, MMP3, MMP12 CYP1A2 173/4885NCF1 1966/4885CYP2C19 349/4885

“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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