SCHEMBL3950898

SCHEMBL3950898

Cc1cc2c(nc(CCCc3ccccc3)n2-c2ccc(CCC(CCc3ccccc3)C(=O)O)cc2)c(C)n1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.46
NTRK1 P04629 1/20 0.37
NTRK2 Q16620 1/20 0.37
FAAH O00519 1/20 0.36
HDAC1 Q13547 1/20 0.35
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
PLA2G4A P47712 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
GRIK1 P39086 1/20 0.34
DDAH1 O94760 1/20 0.34

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
SCHEMBL3950896 0.87 PTGER4 (0.42) PTGER4NTRK1NTRK2HDAC1
SCHEMBL1626154 0.86 PTGER4 (0.46) PTGER4NTRK1NTRK2FAAHHDAC1
SCHEMBL3950900 0.85 PTGER4 (0.42) PTGER4NTRK1NTRK2FAAHHDAC1
SCHEMBL3950902 0.84 RXRA (0.45) PTGER4NTRK1NTRK2FAAHHDAC1
SCHEMBL3950753 0.83 PTGER4 (0.44) PTGER4NTRK1NTRK2FAAHHDAC1
SCHEMBL1626203 0.82 FAAH (0.48) PTGER4NTRK1NTRK2FAAHRXRA
SCHEMBL27600058 0.81 KDM4E (0.37) PTGER4HDAC1MAPTDDAH1
SCHEMBL1623497 0.78 PTGER4 (0.54) PTGER4NTRK1NTRK2TP53
SCHEMBL30114861 0.76 PTGER4 (0.62) PTGER4NTRK1NTRK2TP53
SCHEMBL21470064 0.76 PTGER4 (0.62) PTGER4NTRK1NTRK2TP53

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 2 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

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-20070155732-A1 Aryl or Heteroaryl Fused Imidazole Compounds as Anti-Inflammatory and Analgesic Agents PTGS1, PTGS2, PTGES PTGER4 6/4885NTRK1 3135/4885NTRK2 3428/4885

“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.