SCHEMBL377753

SCHEMBL377753

CN(C)Cc1cc2cc(Br)ccc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.44
▸ IDO1 P14902 5/20 0.42
▸ LOXL2 Q9Y4K0 3/20 0.41
▸ PYGL P06737 2/20 0.40
▸ FLT3 P36888 1/20 0.39
▸ CYP2A6 P11509 1/20 0.39
▸ AHR P35869 1/20 0.39
▸ NR4A2 P43354 1/20 0.39
▸ HRH4 Q9H3N8 1/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.38
▸ SLC6A4 P31645 1/20 0.37
▸ TDO2 P48775 1/20 0.37

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
SCHEMBL8870523 0.84 LOXL2 (0.44) LOXL2FLT3HRH3SLC6A4
SCHEMBL16440998 0.80 CYP19A1 (0.47) CYP19A1IDO1LOXL2FLT3CYP2A6
SCHEMBL11161860 0.80 CYP19A1 (0.47) CYP19A1IDO1LOXL2FLT3CYP2A6
SCHEMBL865591 0.80 CYP19A1 (0.50) CYP19A1IDO1LOXL2FLT3CYP2A6
SCHEMBL21671818 0.79 CYP2A6 (0.53) LOXL2CYP2A6HRH4
SCHEMBL1429226 0.77 LOXL2 (0.67) LOXL2FLT3AHRHRH3
SCHEMBL19964554 0.77 LOXL2 (0.62) CYP19A1IDO1LOXL2CYP2A6AHR
SCHEMBL5100201 0.77 CYP19A1 (0.47) CYP19A1IDO1LOXL2FLT3CYP2A6
SCHEMBL4728647 0.77 LOXL2 (0.58) LOXL2AHRHRH4HRH3
SCHEMBL31388376 0.77 LOXL2 (0.62) CYP19A1IDO1LOXL2CYP2A6AHR

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 14 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
US-20120040954-A1 NOVEL ANTI-INFLAMMATORY AGENTS HEPALINK (HONG KONG) LIMITED (HK) 2012-02-16 — — US disclosed
EP-2408454-A2 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2012-01-25 — — EP disclosed
WO-2010106436-A2 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2010-09-23 — — 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 (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 CYP19A1 4170/4885IDO1 601/4885LOXL2 839/4885
US-20160137613-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 CYP19A1 4289/4885IDO1 731/4885LOXL2 769/4885
US-20130281399-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION PHKB, BAZ2A, EP300 CYP19A1 3733/4885IDO1 3147/4885LOXL2 2280/4885
US-10882828-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 CYP19A1 4170/4885IDO1 601/4885LOXL2 839/4885
US-20210070716-A1 ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 CYP19A1 4170/4885IDO1 601/4885LOXL2 839/4885
US-10131640-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 CYP19A1 4170/4885IDO1 601/4885LOXL2 839/4885
US-20190119222-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 CYP19A1 4289/4885IDO1 731/4885LOXL2 769/4885
US-20120040954-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 CYP19A1 4289/4885IDO1 731/4885LOXL2 769/4885

“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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