SCHEMBL17075715

SCHEMBL17075715

CC(C)(C)N(C(=O)O)[C@H]1CC[C@@H](NS(=O)(=O)c2ccccc2Br)CC1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.58
HTR1A P08908 2/20 0.46
HTR7 P34969 2/20 0.46
L3MBTL1 Q9Y468 3/20 0.39
ALDH1A1 P00352 3/20 0.39
PTGDR Q13258 1/20 0.39
POLB P06746 2/20 0.38
WNT3 P56703 1/20 0.37
SFRP1 Q8N474 1/20 0.37
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL17075716 1.00 MAPT (0.58) MAPTHTR1AHTR7L3MBTL1ALDH1A1
SCHEMBL15915182 0.80 MAPT (0.87) MAPTHTR1AHTR7L3MBTL1ALDH1A1
SCHEMBL15916996 0.78 MAPT (0.68) MAPTHTR1AHTR7L3MBTL1ALDH1A1
SCHEMBL15916994 0.78 MAPT (0.68) MAPTHTR1AHTR7L3MBTL1ALDH1A1
SCHEMBL15916457 0.76 MAPT (0.74) MAPTHTR1AHTR7L3MBTL1ALDH1A1
SCHEMBL15916455 0.76 MAPT (0.74) MAPTHTR1AHTR7L3MBTL1ALDH1A1
SCHEMBL2190597 0.75 CA12 (0.32) ALDH1A1
SCHEMBL15934259 0.75 MAPT (0.59) MAPTHTR1AHTR7L3MBTL1ALDH1A1
SCHEMBL15915230 0.74 MAPT (1.00) MAPTHTR1AHTR7L3MBTL1ALDH1A1
SCHEMBL15915579 0.74 MAPT (0.74) MAPTHTR1AHTR7L3MBTL1ALDH1A1

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-9884878-B2 FLAP modulators JANSSEN PHARMACEUTICA NV (BE) 2018-02-06 US disclosed
US-20150259357-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-09-17 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-20150259357-A1 FLAP MODULATORS PGF, FEN1, TBXA2R MAPT 4867/4885HTR1A 1244/4885HTR7 3440/4885

“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.