SCHEMBL5569804

SCHEMBL5569804

Cc1ccccc1C(=O)c1cnc(NCCCCNS(=O)(=O)c2ccc(F)cc2)s1

nearest known ligand 0.96

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 1/20 0.45
MAPK12 P53778 1/20 0.45
MAPK11 Q15759 1/20 0.45
MAPK14 Q16539 1/20 0.45
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
PKM P14618 1/20 0.44
KMT2A Q03164 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 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
SCHEMBL5567832 0.99 ALDH1A1 (0.46) MAPK13MAPK12MAPK11MAPK14MEN1
SCHEMBL5569779 0.98 MAPK13 (0.45) MAPK13MAPK12MAPK11MAPK14MEN1
SCHEMBL5568715 0.91 ALDH1A1 (0.47) ALDH1A1PKMSMN1; SMN2LMNA
SCHEMBL7151520 0.90 ALDH1A1 (0.47) ALDH1A1
SCHEMBL5564570 0.90 ALDH1A1 (0.43) ALDH1A1PKMNPC1RAB9ASMN1; SMN2
SCHEMBL5568923 0.90 KAT6A (0.43) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL5564727 0.89 KAT6A (0.42) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL5567031 0.89 RORC (0.38) MAPK14ALDH1A1NPC1RAB9A
SCHEMBL5569066 0.89 ALDH1A1 (0.49) MAPK13MAPK12MAPK11MAPK14MEN1
SCHEMBL5568942 0.88 L3MBTL1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480976-B1 THIAZOLE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2007-09-19 EP disclosed
EP-1480976-A1 THIAZOLE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2004-12-01 EP disclosed
US-6686381-B2 COMPOUNDS THAT ANTAGONIZE NEUROPEPTIDE Y AT THE Y5 RECEPTOR SUBTYPE REPRESENT AN APPROACH TO THE TREATMENT OF EATING DISORDERS SUCH AS OBESITY AND HYPERPHAGIA HOFFMANN-LA ROCHE INC. 2004-02-03 US disclosed
US-20030225141-A1 THIAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. 2003-12-04 US disclosed
WO-2003072577-A1 THIAZOLE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2003-09-04 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-20030225141-A1 THIAZOLE DERIVATIVES SLC5A1, GPR119, TAS1R1 MAPK13 3868/4885MAPK12 4156/4885MAPK11 3691/4885

“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.