SCHEMBL15915670

SCHEMBL15915670

O=S(=O)(N[C@@H]1CCc2ccccc21)c1ccccc1Br

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
MAPT P10636 1/20 0.56
ALDH1A1 P00352 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
TSHR P16473 1/20 0.53
MAPK1 P28482 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
PDE4A P27815 1/20 0.52
PDE4B Q07343 1/20 0.52
PDE4C Q08493 1/20 0.52
PDE4D Q08499 1/20 0.52
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
PDPK1 O15530 1/20 0.47
HTT P42858 1/20 0.47
CYP1A2 P05177 1/20 0.47
ALOX5AP P20292 2/20 0.46
FEN1 P39748 2/20 0.46
MAOA P21397 3/20 0.45

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
SCHEMBL15915716 1.00 CA1 (0.60) CA1CA2MAPTALDH1A1SMN1; SMN2
SCHEMBL9577107 0.83 ALDH1A1 (0.54) CA1CA2MAPTALDH1A1SMN1; SMN2
SCHEMBL8404960 0.79 ALDH1A1 (0.69) CA1CA2ALDH1A1SMN1; SMN2TSHR
SCHEMBL9577165 0.78 ALDH1A1 (0.54) CA1CA2ALDH1A1SMN1; SMN2TSHR
SCHEMBL4455048 0.78 CA1 (0.57) CA1CA2ALDH1A1SMN1; SMN2TSHR
SCHEMBL3460292 0.77 PDE4A (0.61) CA1CA2ALDH1A1SMN1; SMN2TSHR
SCHEMBL13660786 0.76 CA1 (0.58) CA1CA2ALDH1A1SMN1; SMN2TSHR
SCHEMBL4759729 0.75 CA1 (1.00) CA1CA2ALDH1A1SMN1; SMN2TSHR
SCHEMBL6337843 0.75 CA1 (0.71) CA1CA2MAPTALDH1A1SMN1; SMN2
SCHEMBL16886879 0.75 CA1 (0.71) CA1CA2ALDH1A1SMN1; SMN2TSHR

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3495359-A1 FLAP MODULATORS Janssen Pharmaceutica NV (BE) 2019-06-12 EP disclosed
EP-3070085-B1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-01-09 EP disclosed
EP-2951170-B1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-10-24 EP disclosed
US-9884878-B2 FLAP modulators JANSSEN PHARMACEUTICA NV (BE) 2018-02-06 US disclosed
US-9884878-B2 FLAP modulators JANSSEN PHARMACEUTICA NV (BE) 2018-02-06 US disclosed
US-9884878-B2 FLAP modulators JANSSEN PHARMACEUTICA NV (BE) 2018-02-06 US disclosed
US-9745328-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2017-08-29 US disclosed
US-9745328-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2017-08-29 US disclosed
US-9745328-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2017-08-29 US disclosed
EP-3070085-A1 FLAP MODULATORS Janssen Pharmaceutica N.V. (BE) 2016-09-21 EP disclosed
US-20150376212-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-12-31 US disclosed
US-20150259357-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-09-17 US disclosed
US-20150259357-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-09-17 US disclosed
US-20150259357-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-09-17 US disclosed
US-9079866-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2015-07-14 US disclosed
US-9079866-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2015-07-14 US disclosed
US-9079866-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2015-07-14 US disclosed
US-20140221311-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (US) 2014-08-07 US disclosed
US-20140221311-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (US) 2014-08-07 US disclosed
US-20140221311-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (US) 2014-08-07 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 (3 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 CA1 3447/4885CA2 4418/4885MAPT 4864/4885
US-20150259357-A1 FLAP MODULATORS PGF, FEN1, TBXA2R CA1 3615/4885CA2 4111/4885MAPT 4867/4885
US-20140221311-A1 FLAP MODULATORS PGF, FEN1, TBXA2R CA1 3615/4885CA2 4111/4885MAPT 4867/4885

“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.