SCHEMBL472634

SCHEMBL472634

Cc1ncoc1-c1ccc(C2CC2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 5/20 0.40
KCNH2 Q12809 2/20 0.40
DGAT1 O75907 1/20 0.39
IMPDH2 P12268 2/20 0.39
MAPK14 Q16539 5/20 0.37
NOTUM Q6P988 4/20 0.36
IMPDH1 P20839 1/20 0.35
DRD2 P14416 5/20 0.34
GPR119 Q8TDV5 1/20 0.34
CYP2D6 P10635 1/20 0.34
FFAR4 Q5NUL3 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
SCHEMBL472496 0.79 IMPDH2 (0.41) IMPDH2MAPK14IMPDH1
SCHEMBL472545 0.76 MAPK14 (0.47) KCNH2IMPDH2MAPK14IMPDH1
SCHEMBL472364 0.76 IMPDH2 (0.39) IMPDH2MAPK14IMPDH1
SCHEMBL472479 0.75 DGAT1 (0.40) DGAT1NOTUM
SCHEMBL472444 0.74 CYP11B2 (0.46)
SCHEMBL9955412 0.72 NOTUM (0.47) IMPDH2MAPK14NOTUM
SCHEMBL472455 0.71 MAPK14 (0.54) IMPDH2MAPK14NOTUMIMPDH1
SCHEMBL472419 0.68 IMPDH2 (0.47) DRD3KCNH2IMPDH2MAPK14IMPDH1
SCHEMBL472514 0.67 AHR (0.45) IMPDH2MAPK14NOTUMIMPDH1
SCHEMBL15929467 0.67 IMPDH2 (0.50) IMPDH2MAPK14NOTUMIMPDH1GPR119

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 DRD3 632/4885KCNH2 224/4885DGAT1 1935/4885

“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.