SCHEMBL17367685

SCHEMBL17367685

CNS(=O)(=O)c1cc(C(F)(F)F)ccc1C

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
MCL1 Q07820 4/20 0.53
ALOX5AP P20292 1/20 0.47
FEN1 P39748 1/20 0.47
IDH1 O75874 11/20 0.47
ALDH1A1 P00352 1/20 0.44
KCNJ6 P48051 1/20 0.44
KCNJ3 P48549 1/20 0.44

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
SCHEMBL19285885 0.82 ALOX5AP (0.52) LMNAMCL1ALOX5APFEN1IDH1
SCHEMBL15915645 0.81 ALOX5AP (0.46) LMNAMCL1ALOX5APFEN1ALDH1A1
SCHEMBL30994933 0.81 ALOX5AP (0.46) LMNAMCL1ALOX5APFEN1ALDH1A1
SCHEMBL16021159 0.80 MCL1 (0.47) MCL1ALOX5APFEN1IDH1ALDH1A1
SCHEMBL27256998 0.79 MCL1 (0.46) LMNAMCL1IDH1KCNJ6KCNJ3
SCHEMBL3088227 0.79 MCL1 (0.49) LMNAMCL1IDH1ALDH1A1KCNJ6
SCHEMBL19285886 0.79 ALDH1A1 (0.59) LMNAMCL1ALOX5APFEN1IDH1
SCHEMBL4183675 0.78 ALOX5AP (0.43) LMNAMCL1ALOX5APFEN1ALDH1A1
SCHEMBL13407614 0.78 MCL1 (0.51) LMNAMCL1ALOX5APFEN1ALDH1A1
SCHEMBL2525525 0.77 LMNA (0.65) LMNAMCL1IDH1ALDH1A1

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-9745328-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2017-08-29 US disclosed
US-20150376212-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-12-31 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-20150376212-A1 FLAP MODULATORS FEN1, PGF, TBXA2R LMNA 3880/4885MCL1 2515/4885ALOX5AP 95/4885

“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.