SCHEMBL1624176

SCHEMBL1624176

CCc1nc2cc(C(C)=O)cnc2n1-c1ccc(C[C@H](C)N(C(=O)O)S(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
TP53 P04637 2/20 0.39
POLB P06746 2/20 0.39
PABPC1 P11940 1/20 0.39
PTGER4 P35408 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TAS2R14 Q9NYV8 2/20 0.33
PDE10A Q9Y233 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KCNA5 P22460 1/20 0.32
MAPT P10636 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
SCHEMBL1627273 1.00 KMT2A (0.40) KMT2AMEN1TP53POLBPABPC1
SCHEMBL1626282 0.87 TP53 (0.39) KMT2AMEN1TP53POLBPTGER4
SCHEMBL1625453 0.87 TP53 (0.39) KMT2AMEN1TP53POLBPTGER4
SCHEMBL1625186 0.87 TP53 (0.39) KMT2AMEN1TP53POLBPTGER4
SCHEMBL7593184 0.82 PTGER4 (0.41) KMT2AMEN1TP53POLBPABPC1
SCHEMBL1627468 0.80 MEN1 (0.49) KMT2AMEN1TP53POLBPABPC1
SCHEMBL1626268 0.80 MEN1 (0.49) KMT2AMEN1TP53POLBPABPC1
SCHEMBL1626150 0.80 PTGER4 (0.42) PTGER4
SCHEMBL1623814 0.80 PTGER4 (0.42) PTGER4
Hydrochloric Acid SCHEMBL1625124 0.79 PTGER4 (0.42) PTGER4

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-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
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20070066618-A1 Use of EP4 Receptor Ligands in the Treatment of IL-6 Involved Diseases PTGER4, PTGER1, IL6 KMT2A 4355/4885MEN1 4475/4885TP53 4291/4885
US-20030236260-A1 Use of EP4 receptor ligands in the treatment of IL-6 involved diseases PTGER4, PTGER1, IL6 KMT2A 4355/4885MEN1 4475/4885TP53 4291/4885
US-20040181059-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents PTGS1, PTGS2, OPRM1 KMT2A 2967/4885MEN1 3934/4885TP53 4398/4885
US-20070155732-A1 Aryl or Heteroaryl Fused Imidazole Compounds as Anti-Inflammatory and Analgesic Agents PTGS1, PTGS2, PTGES KMT2A 3274/4885MEN1 2777/4885TP53 3891/4885

“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.