SCHEMBL6505568

SCHEMBL6505568

Cc1nc2ccc(C(=O)O)nc2n1Cc1ccc(N(C)CC2CCCCC2)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.37
MAPT P10636 2/20 0.36
CDK9 P50750 1/20 0.35
DYRK1A Q13627 1/20 0.35
DYRK2 Q92630 1/20 0.35
ALOX5 P09917 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PTAFR P25105 2/20 0.34
GLP1R P43220 5/20 0.34
BACE1 P56817 1/20 0.34
ABCC1 P33527 1/20 0.33
LTC4S Q16873 1/20 0.33
CNR2 P34972 1/20 0.33
OPRK1 P41145 1/20 0.33
UTS2R Q9UKP6 1/20 0.33

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
SCHEMBL6501931 0.91 TRPV1 (0.37) TRPV1MAPTCDK9DYRK1ADYRK2
SCHEMBL6492876 0.86 GLP1R (0.34) MAPTCDK9DYRK1ADYRK2ALDH1A1
SCHEMBL6494280 0.85 PTGS2 (0.36) TRPV1PTAFRCNR2
SCHEMBL6305870 0.84 ALDH1A1 (0.41) MAPTALDH1A1SMN1; SMN2GLP1RBACE1
SCHEMBL6299020 0.84 KCNH2 (0.39) MAPTCDK9DYRK1ADYRK2ALDH1A1
SCHEMBL6493826 0.84 PPARG (0.52) TRPV1CNR2
SCHEMBL6300962 0.82 ALOX5AP (0.41) MAPTCDK9DYRK1ADYRK2ALDH1A1
SCHEMBL6299190 0.81 PPARG (0.42) TRPV1MAPTCDK9DYRK1AALDH1A1
SCHEMBL6299153 0.81 ALOX5AP (0.41) MAPTALDH1A1SMN1; SMN2GLP1R
SCHEMBL6505566 0.80 CDK9 (0.41) MAPTCDK9DYRK1ADYRK2ALDH1A1

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-6890934-B2 Sulfonamide compounds and uses thereof as medicines FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-05-10 US disclosed
US-20030171396-A1 Sulfonamide compounds and uses thereof as medicines FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2003-09-11 US disclosed
US-6573274-B1 Treatment of the diseases curable based on a hypoglycemic action, and the diseases curable based on a cGMP-PDE inhibitory action, a smooth muscle relaxing action, a bronchodilating action, a vasodilating action, a smooth muscle FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2003-06-03 US disclosed
EP-1136492-A1 SULFONAMIDE COMPOUNDS AND USES THEREOF AS MEDICINES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-09-26 EP 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-20030171396-A1 Sulfonamide compounds and uses thereof as medicines PDE2A, PDE3A, PDE5A TRPV1 257/4885MAPT 4144/4885CDK9 1879/4885

“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.