SCHEMBL1624469

SCHEMBL1624469

Cc1ccc(S(=O)(=O)N(CCc2ccc(-n3c(CCCN4CCCCC4=O)nc4cc(C(F)(F)F)c(Cl)cc43)cc2)C(=O)O)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 3/20 0.35
HPGD P15428 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
NTRK1 P04629 1/20 0.33
NTRK2 Q16620 1/20 0.33
PDK1 Q15118 1/20 0.33
PDK2 Q15119 1/20 0.33
PDK3 Q15120 1/20 0.33
PDK4 Q16654 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 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
SCHEMBL1626739 0.99 L3MBTL1 (0.36) L3MBTL1ALDH1A1KDM4EHPGDMEN1
SCHEMBL1626072 0.86 ALDH1A1 (0.39) ALDH1A1HPGDMEN1KMT2ANTRK1
SCHEMBL1623250 0.86 PTGER4 (0.41) NTRK1NTRK2CNR2MAPTPTGER4
SCHEMBL1626005 0.86 ALDH1A1 (0.38) ALDH1A1HPGDMEN1KMT2ANTRK1
SCHEMBL1625686 0.85 NTRK1 (0.35) KMT2ANTRK1NTRK2CNR2MAPT
SCHEMBL6710720 0.84 PTGER4 (0.39) ALDH1A1MEN1KMT2ANTRK1NTRK2
SCHEMBL6713167 0.84 PTGER4 (0.41) ALDH1A1MEN1KMT2ANTRK1NTRK2
SCHEMBL7590803 0.83 PDK1 (0.37) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL6714655 0.83 PTGER4 (0.38) ALDH1A1MEN1KMT2ANTRK1NTRK2
SCHEMBL1625772 0.82 ALDH1A1 (0.36) ALDH1A1KDM4EMEN1KMT2AHDAC1

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 8 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-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
US-20040181059-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents ASKAT INC. (JP) 2004-09-16 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 (5 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 L3MBTL1 3625/4885ALDH1A1 588/4885KDM4E 3701/4885
US-20070066618-A1 Use of EP4 Receptor Ligands in the Treatment of IL-6 Involved Diseases PTGER4, PTGER1, IL6 L3MBTL1 2756/4885ALDH1A1 1858/4885KDM4E 3970/4885
US-20030236260-A1 Use of EP4 receptor ligands in the treatment of IL-6 involved diseases PTGER4, PTGER1, IL6 L3MBTL1 2756/4885ALDH1A1 1858/4885KDM4E 3970/4885
US-20040181059-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents PTGS1, PTGS2, OPRM1 L3MBTL1 3607/4885ALDH1A1 632/4885KDM4E 3750/4885
US-20020077329-A1 EP4 receptor inhibitors to treat rheumatoid arthritis PTGER4, PTGER1, PTGER2 L3MBTL1 4466/4885ALDH1A1 1286/4885KDM4E 1206/4885

“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.