SCHEMBL1623978

SCHEMBL1623978

Cc1ccc(S(=O)(=O)N(CCc2ccc(-n3c(CCCc4cccnc4)nc4cc(C(F)(F)F)c(Cl)cc43)cc2)C(=O)O)cc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 5/20 0.35
MAPT P10636 1/20 0.35
CXCR3 P49682 3/20 0.35
NAMPT P43490 2/20 0.35
HTT P42858 1/20 0.35
TRPM8 Q7Z2W7 2/20 0.34
NTRK1 P04629 1/20 0.34
NTRK2 Q16620 1/20 0.34
CRHR1 P34998 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TBXA2R P21731 3/20 0.33
CNR2 P34972 1/20 0.33
KCNA5 P22460 1/20 0.33

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
SCHEMBL1625686 0.93 NTRK1 (0.35) MAPTTRPM8NTRK1NTRK2CRHR1
SCHEMBL1625767 0.90 TBXAS1 (0.37) TBXAS1MAPTCXCR3TRPM8NTRK1
SCHEMBL1625772 0.88 ALDH1A1 (0.36) CXCR3TRPM8NTRK1NTRK2ALDH1A1
SCHEMBL1625360 0.88 AOC3 (0.37) TBXAS1MAPTCXCR3NAMPTTRPM8
SCHEMBL1623250 0.87 PTGER4 (0.41) MAPTTRPM8NTRK1NTRK2CNR2
SCHEMBL3949473 0.87 PTGER2 (0.37) MAPT
SCHEMBL7263143 0.86 ALDH1A1 (0.34) CXCR3TRPM8NTRK1NTRK2ALDH1A1
SCHEMBL6713167 0.85 PTGER4 (0.41) MAPTHTTTRPM8NTRK1NTRK2
SCHEMBL6710720 0.85 PTGER4 (0.39) MAPTTRPM8NTRK1NTRK2ALDH1A1
SCHEMBL6714655 0.84 PTGER4 (0.38) TRPM8NTRK1NTRK2ALDH1A1CNR2

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
US-7928119-B2 Use of EP4 receptor ligands in the treatment of IL-6 involved diseases PFIZER INC. (US) 2011-04-19 US disclosed
US-7479564-B2 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents RAQUALIA PHARMA INC. (JP) 2009-01-20 US disclosed
US-20070155732-A1 Aryl or Heteroaryl Fused Imidazole Compounds as Anti-Inflammatory and Analgesic Agents PFIZER INC. 2007-07-05 US disclosed
US-20070066618-A1 Use of EP4 Receptor Ligands in the Treatment of IL-6 Involved Diseases PFIZER INC. 2007-03-22 US disclosed
US-7148234-B2 Use of EP4 receptor ligands in the treatment of IL-6 involved diseases PFIZER INC. (US) 2006-12-12 US disclosed
US-7141580-B2 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents PFIZER INC. (US) 2006-11-28 US disclosed
EP-1666480-A1 Aryl or Heteroaryl Fused Imidazole Compounds as intermediates for Anti-Inflammatory And Analgesic Agents. PFIZER PHARMACEUTICALS INC. (JP) 2006-06-07 EP disclosed
EP-1326864-B1 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMA (JP) 2006-03-15 EP disclosed
US-20040181059-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents ASKAT INC. (JP) 2004-09-16 US disclosed
US-6710054-B2 CONTAINING SULFONYLAMINOCARBONYL GROUPS; PROSTAGLANDIN INHIBITORS PFIZER INC 2004-03-23 US disclosed
US-20030236260-A1 Use of EP4 receptor ligands in the treatment of IL-6 involved diseases SHIMOJO MASATO 2003-12-25 US disclosed
US-20020107273-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents ASKAT INC. (JP) 2002-08-08 US disclosed
US-20020077329-A1 EP4 receptor inhibitors to treat rheumatoid arthritis PFIZER PHARMACEUTICALS INC. (JP) 2002-06-20 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 (6 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-20020107273-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents PTGS1, PTGS2, OPRM1 TBXAS1 901/4885MAPT 3250/4885CXCR3 696/4885
US-20070066618-A1 Use of EP4 Receptor Ligands in the Treatment of IL-6 Involved Diseases PTGER4, PTGER1, IL6 TBXAS1 121/4885MAPT 4402/4885CXCR3 292/4885
US-20030236260-A1 Use of EP4 receptor ligands in the treatment of IL-6 involved diseases PTGER4, PTGER1, IL6 TBXAS1 121/4885MAPT 4402/4885CXCR3 292/4885
US-20040181059-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents PTGS1, PTGS2, OPRM1 TBXAS1 845/4885MAPT 3288/4885CXCR3 724/4885
US-20070155732-A1 Aryl or Heteroaryl Fused Imidazole Compounds as Anti-Inflammatory and Analgesic Agents PTGS1, PTGS2, PTGES TBXAS1 224/4885MAPT 3806/4885CXCR3 890/4885
US-20020077329-A1 EP4 receptor inhibitors to treat rheumatoid arthritis PTGER4, PTGER1, PTGER2 TBXAS1 155/4885MAPT 4854/4885CXCR3 352/4885

“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.