SCHEMBL3949286

SCHEMBL3949286

[CH2]Cc1ccc(-n2c(CC)nc3cc(-c4cccnc4)ccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALOX5AP P20292 1/20 0.43
AKT1 P31749 4/20 0.43
AKT2 P31751 2/20 0.43
MAPT P10636 4/20 0.42
CYP11B1 P15538 4/20 0.41
CYP11B2 P19099 4/20 0.41
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
PDPK1 O15530 1/20 0.39
AOC2 O75106 1/20 0.39
CYP19A1 P11511 1/20 0.39
AOC3 Q16853 1/20 0.38
DHFR P00374 1/20 0.38

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
SCHEMBL3950450 0.88 NTRK1 (0.36) MEN1KMT2AALOX5APAKT1MAPT
SCHEMBL3951329 0.88 PDE10A (0.40) MEN1KMT2AMAPT
SCHEMBL1626764 0.87 MEN1 (0.44) MEN1KMT2AALOX5APAKT1AKT2
SCHEMBL3947558 0.86 AAK1 (0.40) MEN1KMT2AALOX5APMAPTAOC3
SCHEMBL3951321 0.80 PIK3CA (0.41)
SCHEMBL3952497 0.80 MEN1 (0.43) MEN1KMT2AALOX5APDHFR
SCHEMBL26344498 0.78 MAPT (0.45) MEN1KMT2AAKT1MAPTCYP11B1
SCHEMBL26344513 0.77 MAPT (0.44) MEN1KMT2AAKT1MAPTCYP11B1
SCHEMBL3951315 0.77 KMT2A (0.40) MEN1KMT2AMAPTAOC2
SCHEMBL3948783 0.76 NTRK1 (0.48) MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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

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

For each of this compound's patents that has machine-readable text (2 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 MEN1 4475/4885KMT2A 4355/4885ALOX5AP 196/4885
US-20070155732-A1 Aryl or Heteroaryl Fused Imidazole Compounds as Anti-Inflammatory and Analgesic Agents PTGS1, PTGS2, PTGES MEN1 2777/4885KMT2A 3274/4885ALOX5AP 1235/4885

“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.