SCHEMBL472357

SCHEMBL472357

Fc1cc(C(F)(F)F)ccc1-c1ocnc1Br

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MPL P40238 1/20 0.41
FEN1 P39748 9/20 0.40
ALOX5AP P20292 8/20 0.40
CYP11B2 P19099 5/20 0.38
CYP11B1 P15538 4/20 0.38
HSD11B1 P28845 1/20 0.36
IDO1 P14902 1/20 0.36
APP P05067 1/20 0.35
NOTUM Q6P988 1/20 0.34
PDE2A O00408 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
SCHEMBL472440 0.82 HSD11B1 (0.42) MPLFEN1ALOX5APCYP11B2CYP11B1
SCHEMBL472583 0.78 MPL (0.39) MPLFEN1ALOX5APCYP11B2CYP11B1
SCHEMBL472653 0.76 GSK3B (0.45) NOTUM
SCHEMBL472369 0.69 IMPDH2 (0.48) MPLFEN1ALOX5APCYP11B2CYP11B1
SCHEMBL3723567 0.69 FEN1 (0.58) MPLFEN1ALOX5APAPP
SCHEMBL3713639 0.68 FEN1 (0.53) MPLFEN1ALOX5APCYP11B2CYP11B1
SCHEMBL27586620 0.67 APP (0.54) MPLFEN1ALOX5APIDO1APP
SCHEMBL472461 0.67 ALOX5AP (0.38) FEN1ALOX5APNOTUM
SCHEMBL11241077 0.67 MPL (0.44) MPLFEN1ALOX5APCYP11B2CYP11B1
SCHEMBL25261119 0.66 FEN1 (0.58) MPLFEN1ALOX5APCYP11B2CYP11B1

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 MPL 4565/4885FEN1 4859/4885ALOX5AP 882/4885

“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.