SCHEMBL460827

SCHEMBL460827

O=c1ncn2nc(Sc3ccccc3)ccc2c1-c1c(Cl)cccc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 1.00
MAPK13 O15264 14/20 1.00
MAPK12 P53778 14/20 1.00
MAPK11 Q15759 14/20 1.00

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
SCHEMBL12139581 0.90 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL12139555 0.90 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL12139565 0.90 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL12139545 0.89 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL12139561 0.88 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL12139569 0.88 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL12139563 0.87 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL12139587 0.86 MAPK14 (0.75) MAPK14MAPK13MAPK12MAPK11
SCHEMBL12139566 0.85 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL12139546 0.85 MAPK14 (0.73) MAPK14MAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180071376-A1 TOLEROGENIC NANOPARTICLES FOR TREATING DIABETES MELLITUS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2018-03-15 US claimed
EP-3274053-A1 TOLEROGENIC NANOPARTICLES FOR TREATING DIABETES MELLITUS The Brigham and Women's Hospital, Inc. (US) 2018-01-31 EP claimed
WO-2016154362-A1 TOLEROGENIC NANOPARTICLES FOR TREATING DIABETES MELLITUS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2016-09-29 WO claimed
US-10994082-B2 Inhaler counter ASTRAZENECA AB (SE) 2021-05-04 US disclosed
US-20200308176-A1 CO-CRYSTALS OF NEFLAMAPIMOD (VX-745) EIP PHARMA, LLC (US) 2020-10-01 US disclosed
US-20190175849-A1 INHALER COUNTER BANG & OLUFSEN MEDICOM A/S (DK) 2019-06-13 US disclosed
WO-2019056003-A1 CO-CRYSTALS OF NEFLAMAPIMOD (VX-745) EIP PHARMA, LLC (US) 2019-03-21 WO disclosed
US-20180339119-A1 INHALER BANG & OLUFSEN MEDICOM A/S (DK) 2018-11-29 US disclosed
EP-2755707-B1 INHALER ASTRAZENECA AB (SE) 2018-11-14 EP disclosed
EP-3345644-A1 INHALER Astrazeneca AB (SE) 2018-07-11 EP disclosed
EP-2755708-B1 INHALER ASTRAZENECA AB (SE) 2018-05-09 EP disclosed
WO-2009037503-A2 NEW COMBINATION - 012 FOR THE TREATMENT OF RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2009-03-26 WO disclosed
US-20080242649-A1 New Combination 665 ASTRAZENECA AB (SE) 2008-10-02 US disclosed
WO-2008104776-A1 COMBINATIONS OF BETA-2-ADRENOCEPTOR AGONISTIC BENZOTHIAZOLONE ASTRAZENECA AB (SE) 2008-09-04 WO disclosed
WO-2008096111-A1 COMBINATIONS OF BETA- 2 -ADRENOCEPTOR AGONISTIC BENZOTHIAZOLONE ASTRAZENECA AB (SE) 2008-08-14 WO disclosed
WO-2008096121-A1 COMBINATIONS OF BETA-2-ADRENOCEPTOR AGONISTIC BENZOTHIAZOLONE ASTRAZENECA AB (SE) 2008-08-14 WO disclosed
US-7365072-B2 Inhibitors of p38 VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-04-29 US disclosed
US-7365072-B2 Inhibitors of p38 VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-04-29 US disclosed
US-7205305-B2 Inhibitors of p38 VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-04-17 US disclosed
US-7205305-B2 Inhibitors of p38 VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-04-17 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 (3 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-20080242649-A1 New Combination 665 NR3C2, PTGER2, GRK5 MAPK14 361/4885MAPK13 507/4885MAPK12 273/4885
US-20180071376-A1 TOLEROGENIC NANOPARTICLES FOR TREATING DIABETES MELLITUS IAPP, NFATC1, CD4 MAPK14 2820/4885MAPK13 1694/4885MAPK12 1316/4885
US-20200308176-A1 CO-CRYSTALS OF NEFLAMAPIMOD (VX-745) PRKX, PRKACA, VRK2 MAPK14 249/4885MAPK13 360/4885MAPK12 410/4885

“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.