SCHEMBL616859

SCHEMBL616859

CN(C)Cc1cc2cc(C=O)ccc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 4/20 0.44
▸ LOXL2 Q9Y4K0 3/20 0.38
▸ KIF11 P52732 2/20 0.38
▸ KDR P35968 1/20 0.35
▸ CYP2A13 Q16696 1/20 0.34
▸ SIRT1 Q96EB6 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
SCHEMBL9009152 0.85 CYP2A6 (0.41) CYP2A6LOXL2KIF11
SCHEMBL378037 0.79 CYP2A6 (0.47) CYP2A6LOXL2KIF11SIRT1
SCHEMBL31115552 0.76 CYP2A6 (0.45) CYP2A6LOXL2KIF11SIRT1
SCHEMBL376513 0.76 CYP2A6 (0.45) CYP2A6LOXL2KIF11SIRT1
SCHEMBL377753 0.76 CYP19A1 (0.44) CYP2A6LOXL2
SCHEMBL21671818 0.76 CYP2A6 (0.53) CYP2A6LOXL2KDRSIRT1
SCHEMBL28258093 0.75 CYP2A6 (0.44) CYP2A6LOXL2KIF11SIRT1
SCHEMBL2648417 0.75 SIRT1 (0.47) CYP2A6LOXL2KIF11SIRT1
SCHEMBL1429226 0.73 LOXL2 (0.67) LOXL2
SCHEMBL4074346 0.73 CYP2A6 (0.53) CYP2A6KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2408454-B1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP (CA) 2024-07-24 — — EP disclosed
US-11407719-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2022-08-09 — — US disclosed
US-20210070716-A1 ANTI-INFLAMMATORY AGENTS HEPALINK (HONG KONG) LIMITED (HK) 2021-03-11 — — US disclosed
US-10882828-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2021-01-05 — — US disclosed
US-20190119222-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2019-04-25 — — US disclosed
US-10131640-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2018-11-20 — — US disclosed
CN-105859639-A NOVEL ANTI-INFLAMMATORY AGENTS 雷斯韦洛吉克斯公司 2016-08-17 — — CN disclosed
US-20160137613-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2016-05-19 — — US disclosed
US-9238640-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2016-01-19 — — US disclosed
WO-2013175281-A1 USE OF SUBSTITUTED 2-PHENYL-3H-QUINAZOLIN-4-ONES AND ANALOGS FOR INHIBITING BROMODOMAIN AND EXTRA TERMINAL DOMAIN (BET) PROTEINS RVX THERAPEUTICS INC. (CA) 2013-11-28 — — WO disclosed
US-20130281399-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION RVX THERAPEUTICS INC. (CA) 2013-10-24 — — US disclosed
CN-102427813-A Novel anti-inflammatory agents RESVERLOGIX CORP 2012-04-25 — — CN disclosed
US-20120040954-A1 NOVEL ANTI-INFLAMMATORY AGENTS HEPALINK (HONG KONG) LIMITED (HK) 2012-02-16 — — 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 (8 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-11407719-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 CYP2A6 480/4885LOXL2 839/4885KIF11 4421/4885
US-20160137613-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 CYP2A6 434/4885LOXL2 769/4885KIF11 4344/4885
US-20130281399-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION PHKB, BAZ2A, EP300 CYP2A6 4600/4885LOXL2 2280/4885KIF11 3494/4885
US-10882828-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 CYP2A6 480/4885LOXL2 839/4885KIF11 4421/4885
US-20210070716-A1 ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 CYP2A6 480/4885LOXL2 839/4885KIF11 4421/4885
US-10131640-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 CYP2A6 480/4885LOXL2 839/4885KIF11 4421/4885
US-20190119222-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 CYP2A6 434/4885LOXL2 769/4885KIF11 4344/4885
US-20120040954-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 CYP2A6 434/4885LOXL2 769/4885KIF11 4344/4885

“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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