SCHEMBL6490770

SCHEMBL6490770

Cc1nc2ccc(C(=O)O)nc2n1Cc1ncc(NC(=O)OC(C)(C)C)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 2/20 0.39
MAPKAPK2 P49137 4/20 0.37
ACSS2 Q9NR19 1/20 0.37
BRD4 O60885 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
P2RX7 Q99572 1/20 0.35
TRPA1 O75762 1/20 0.35
SCD O00767 1/20 0.35

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
SCHEMBL6500785 0.92 NPC1 (0.38) P2RX3MAPKAPK2ACSS2BRD4SMN1; SMN2
SCHEMBL6491410 0.89 ALDH1A1 (0.39) MAPKAPK2SMN1; SMN2NPC1LMNAKMT2A
SCHEMBL6491426 0.88 SMN1; SMN2 (0.36) SMN1; SMN2NPC1LMNAKMT2AALDH1A1
SCHEMBL6497514 0.86 ALDH1A1 (0.46) P2RX3MAPKAPK2ACSS2BRD4SMN1; SMN2
SCHEMBL6493836 0.85 PTGS2 (0.38) P2RX3KMT2A
SCHEMBL6492586 0.84 PPARG (0.44) P2RX3MAPKAPK2ACSS2HDAC4HDAC1
SCHEMBL7170792 0.83 RORC (0.42) P2RX3
SCHEMBL6498241 0.83 SCN9A (0.33) P2RX3MAPKAPK2ACSS2SMN1; SMN2NPC1
SCHEMBL6498248 0.83 SCN9A (0.33) P2RX3MAPKAPK2ACSS2SMN1; SMN2NPC1
SCHEMBL6501157 0.81 ALDH1A1 (0.39) MAPKAPK2SMN1; SMN2NPC1LMNAKMT2A

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 P2RX3 814/4885MAPKAPK2 1363/4885ACSS2 1873/4885

“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.