SCHEMBL616627

SCHEMBL616627

OCc1ccc2[nH]nc(COC3CCCCO3)c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ICAM1 P05362 1/20 0.38
SELE P16581 1/20 0.38
KDM4C Q9H3R0 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.35
MAP2K4 P45985 2/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CREBBP Q92793 2/20 0.33
EP300 Q09472 1/20 0.33
P2RX3 P56373 2/20 0.33
GSK3B P49841 2/20 0.33
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
GRK2 P25098 1/20 0.32
CLK1 P49759 1/20 0.32
NPSR1 Q6W5P4 2/20 0.31
ALDH1A1 P00352 2/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL378275 0.81 KDM4C (0.36) ICAM1SELEKDM4CL3MBTL1NPC1
SCHEMBL377757 0.80 MEN1 (0.42) L3MBTL1NPC1RAB9AMEN1KMT2A
SCHEMBL29746500 0.75 KDM4C (0.36) ICAM1SELEKDM4CL3MBTL1NPC1
SCHEMBL1732484 0.75 ALDH1A1 (0.46) ICAM1SELEL3MBTL1NPC1RAB9A
SCHEMBL19635179 0.74 KDM4C (0.34) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL29901043 0.74 CREBBP (0.38) ICAM1SELEKDM4CL3MBTL1NPC1
SCHEMBL1732627 0.73 KDM4C (0.41) ICAM1SELEKDM4CL3MBTL1NPC1
SCHEMBL13141254 0.72 KDM4C (0.44) ICAM1SELEKDM4CL3MBTL1NPC1
SCHEMBL2568655 0.70 KDM4C (0.47) ICAM1SELEKDM4CL3MBTL1NPC1
SCHEMBL9052973 0.70 ALDH1A1 (0.42) ICAM1SELENPC1RAB9AMEN1

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 10 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
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
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

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 ICAM1 2/4885SELE 15/4885KDM4C 4213/4885
US-20160137613-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 ICAM1 2/4885SELE 18/4885KDM4C 3902/4885
US-20130281399-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION PHKB, BAZ2A, EP300 ICAM1 2683/4885SELE 3757/4885KDM4C 396/4885
US-10882828-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 ICAM1 2/4885SELE 15/4885KDM4C 4213/4885
US-20210070716-A1 ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 ICAM1 2/4885SELE 15/4885KDM4C 4213/4885
US-10131640-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 ICAM1 2/4885SELE 15/4885KDM4C 4213/4885
US-20190119222-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 ICAM1 2/4885SELE 18/4885KDM4C 3902/4885
US-20120040954-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 ICAM1 2/4885SELE 18/4885KDM4C 3902/4885

“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.