SCHEMBL6646016

SCHEMBL6646016

Fc1ccc(-c2c(-c3ccncc3)[nH]c3ccccc23)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 1.00
MAPK13 O15264 4/20 0.68
MAPK12 P53778 4/20 0.68
MAPK11 Q15759 4/20 0.68
PTGS2 P35354 2/20 0.62
ESR1 P03372 3/20 0.59
ESR2 Q92731 3/20 0.59
IMPDH2 P12268 1/20 0.58

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
SCHEMBL6646025 1.00 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11PTGS2
SCHEMBL7042862 0.90 MAPK14 (0.81) MAPK14MAPK13MAPK12MAPK11PTGS2
SCHEMBL4887669 0.87 ESR1 (0.79) MAPK14MAPK13MAPK12MAPK11PTGS2
SCHEMBL6643643 0.86 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL17883133 0.83 MAPK14 (0.70) MAPK14MAPK13MAPK12MAPK11PTGS2
SCHEMBL284987 0.81 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6250930 0.81 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL27546673 0.81 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL13740955 0.78 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL12561630 0.78 MAPK14 (0.65) MAPK14MAPK13MAPK12MAPK11IMPDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605634-B2 Tumor necrosis factor alpha and interleukin-1 (IL-1) mediated diseases; pain, diabetes; cyclooxygenase inhibition AMGEN, INC. 2003-08-12 US claimed
US-20030096819-A1 Aryl and heteroaryl substituted fused pyrrole anti-inflammatory agents AMGEN INC. 2003-05-22 US claimed
CN-1246856-A Aryl and heteroaryl substituted fused pyrrole antiinflammatory agents AMGEN INC (US) 2000-03-08 CN claimed
EP-0948495-A1 ARYL AND HETEROARYL SUBSTITUTED FUSED PYRROLE ANTIINFLAMMATORY AGENTS Amgen Inc., (US) 1999-10-13 EP claimed
WO-1998022457-A9 ARYL AND HETEROARYL SUBSTITUTED FUSED PYRROLE ANTIINFLAMMATORY AGENTS 1998-08-20 WO claimed
WO-1998022457-A1 ARYL AND HETEROARYL SUBSTITUTED FUSED PYRROLE ANTIINFLAMMATORY AGENTS AMGEN INC. (US) 1998-05-28 WO claimed
EP-0948495-B1 ARYL AND HETEROARYL SUBSTITUTED FUSED PYRROLE ANTIINFLAMMATORY AGENTS AMGEN INC (US) 2004-04-14 EP disclosed
US-6605634-B2 Tumor necrosis factor alpha and interleukin-1 (IL-1) mediated diseases; pain, diabetes; cyclooxygenase inhibition AMGEN, INC. 2003-08-12 US disclosed
US-20030096819-A1 Aryl and heteroaryl substituted fused pyrrole anti-inflammatory agents AMGEN INC. 2003-05-22 US disclosed
US-6440973-B1 Aryl and heteroaryl substituted fused pyrrole antiinflammatory agents AMGEN INC. 2002-08-27 US disclosed
US-6180643-B1 ANTAGONIST OF INTERLEUKINS, TUMOR NECROSIS FACTOR AMGEN INC. 2001-01-30 US disclosed
CN-1246856-A Aryl and heteroaryl substituted fused pyrrole antiinflammatory agents AMGEN INC (US) 2000-03-08 CN disclosed
EP-0948495-A1 ARYL AND HETEROARYL SUBSTITUTED FUSED PYRROLE ANTIINFLAMMATORY AGENTS Amgen Inc., (US) 1999-10-13 EP disclosed
WO-1998022457-A9 ARYL AND HETEROARYL SUBSTITUTED FUSED PYRROLE ANTIINFLAMMATORY AGENTS 1998-08-20 WO disclosed
WO-1998022457-A1 ARYL AND HETEROARYL SUBSTITUTED FUSED PYRROLE ANTIINFLAMMATORY AGENTS AMGEN INC. (US) 1998-05-28 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 (1 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-20030096819-A1 Aryl and heteroaryl substituted fused pyrrole anti-inflammatory agents TNF, IL1A, IL6 MAPK14 2705/4885MAPK13 2534/4885MAPK12 1983/4885

“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.