SCHEMBL472545

SCHEMBL472545

Cc1ncoc1-c1ccc(Cl)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.47
IMPDH2 P12268 2/20 0.39
KMO O15229 2/20 0.38
IMPDH1 P20839 1/20 0.38
EGLN2 Q96KS0 1/20 0.38
PGR P06401 1/20 0.35
GRM2 Q14416 1/20 0.35
BDKRB2 P30411 1/20 0.35
ABL1 P00519 1/20 0.35
KCNH2 Q12809 1/20 0.34
TRPV1 Q8NER1 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
SCHEMBL472514 0.85 AHR (0.45) MAPK14IMPDH2KMOIMPDH1
SCHEMBL472496 0.83 IMPDH2 (0.41) MAPK14IMPDH2KMOIMPDH1
SCHEMBL472364 0.81 IMPDH2 (0.39) MAPK14IMPDH2IMPDH1
SCHEMBL472444 0.78 CYP11B2 (0.46) TRPV1
SCHEMBL472537 0.77 KMO (0.42) IMPDH2KMOIMPDH1GRM2
SCHEMBL472634 0.76 DRD3 (0.40) MAPK14IMPDH2IMPDH1KCNH2
SCHEMBL472455 0.75 MAPK14 (0.54) MAPK14IMPDH2IMPDH1
SCHEMBL472411 0.75 GAA (0.49) MAPK14IMPDH2IMPDH1
SCHEMBL472410 0.74 ABL1 (0.40) MAPK14KMOEGLN2PGRGRM2
SCHEMBL9953638 0.73 NOTUM (0.47) MAPK14IMPDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2412372-A1 2-Aminooxazole derivatives for use as TRPV1 antagonists for treating i.a. pain, inflammation, neurodegenerative diseases or gastrointestinal diseases Abbott Laboratories (US) 2012-02-01 EP disclosed
US-7998993-B2 TRPV1 antagonists ABBOTT LABORATORIES (US) 2011-08-16 US disclosed
EP-2220059-B1 2-AMINOOXAZOLE DERIVATIVES AS TRPVL ANTAGONISTS USEFUL FOR TREATING PAIN ABBOTT LAB (US) 2011-08-03 EP disclosed
EP-2220059-A1 2-AMINOOXAZOLE DERIVATIVES AS TRPVL ANTAGONISTS USEFUL FOR TREATING PAIN Abbott Laboratories (US) 2010-08-25 EP disclosed
US-20090124666-A1 TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2009-05-14 US disclosed
WO-2009055749-A1 2-AMINOOXAZOLE DERIVATIVES AS TRPVL ANTAGONISTS USEFUL FOR TREATING PAIN ABBOTT LABORATORIES (US) 2009-04-30 WO 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-20090124666-A1 TRPV1 ANTAGONISTS TRPV1, TRPV2, TRPV3 MAPK14 3543/4885IMPDH2 4461/4885KMO 997/4885

“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.