SCHEMBL13419611

SCHEMBL13419611

CC(C)(C)OC(=O)N1CCC(COc2ccc([N+](=O)[O-])cc2F)CC1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
GPR119 Q8TDV5 12/20 0.49
SCN9A Q15858 2/20 0.47
ALOX5AP P20292 1/20 0.45
FEN1 P39748 1/20 0.45
S1PR4 O95977 1/20 0.43
CSF1R P07333 1/20 0.42

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
SCHEMBL13419616 0.89 SCN9A (0.59) ALDH1A1LMNAMAPTGPR119SCN9A
SCHEMBL21644472 0.88 ALDH1A1 (0.50) ALDH1A1LMNAMAPTGPR119
SCHEMBL4369008 0.86 ALDH1A1 (0.50) ALDH1A1LMNAMAPTGPR119CSF1R
SCHEMBL450240 0.85 ALDH1A1 (0.47) ALDH1A1LMNAMAPTGPR119SCN9A
SCHEMBL23783010 0.85 MAPT (0.54) ALDH1A1LMNAMAPTGPR119
SCHEMBL30207533 0.85 MAPT (0.54) ALDH1A1LMNAMAPTGPR119
SCHEMBL2255441 0.85 GPR119 (0.64) ALDH1A1LMNAMAPTGPR119
SCHEMBL31216598 0.85 GPR119 (0.64) ALDH1A1LMNAMAPTGPR119
SCHEMBL31216608 0.85 GPR119 (0.64) ALDH1A1LMNAMAPTGPR119
SCHEMBL31333619 0.84 MAPT (0.53) ALDH1A1LMNAMAPTGPR119

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7671058-B2 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-03-02 US disclosed
US-7671058-B2 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-03-02 US disclosed
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-09-18 US disclosed
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-09-18 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-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives STAT6, RELA, NFKB2 ALDH1A1 2263/4885LMNA 2990/4885MAPT 4713/4885

“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.