SCHEMBL6501556

SCHEMBL6501556

CCCOc1ccc(Cn2c(C)nc3c(C)cc(C(=O)O)nc32)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CB P42338 2/20 0.38
EDNRB P24530 1/20 0.38
MCL1 Q07820 1/20 0.37
DHODH Q02127 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DCTPP1 Q9H773 1/20 0.35
S1PR1 P21453 1/20 0.34
PRKX P51817 1/20 0.34
ACVR1 Q04771 1/20 0.34
S1PR5 Q9H228 1/20 0.34
PTGER1 P34995 1/20 0.34

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
SCHEMBL6491824 0.94 THRB (0.40) PIK3CBMCL1
SCHEMBL6298602 0.93 PIK3CB (0.38) PIK3CBMCL1ALDH1A1MAPTSMN1; SMN2
SCHEMBL6491955 0.90 DCTPP1 (0.35) EDNRBKMT2AALDH1A1MAPTDCTPP1
SCHEMBL6301111 0.86 ALDH1A1 (0.40) EDNRBMCL1DHODHKMT2AALDH1A1
SCHEMBL6493873 0.85 THRB (0.40) DCTPP1
SCHEMBL6305821 0.85 SLC16A3 (0.38) PIK3CBMAPT
SCHEMBL6301216 0.84 PIK3CB (0.42) PIK3CB
SCHEMBL6501078 0.84 PPARG (0.49)
SCHEMBL6299995 0.83 KDM4E (0.41) KMT2AALDH1A1MAPTSMN1; SMN2DCTPP1
SCHEMBL6491820 0.83 PPARG (0.52)

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 PIK3CB 1729/4885EDNRB 411/4885MCL1 3645/4885

“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.