SCHEMBL6299172

SCHEMBL6299172

CSc1ccc(Cn2c(C)nc3c(C)cc(C(=O)O)nc32)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
PIK3CB P42338 3/20 0.39
PIK3C2B O00750 3/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
DCTPP1 Q9H773 1/20 0.34
GPR35 Q9HC97 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
PPARG P37231 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
SCHEMBL6300565 0.89 DCTPP1 (0.36) MAPTPIK3CBALDH1A1SMN1; SMN2DCTPP1
SCHEMBL6306026 0.86 PTGDR2 (0.38) MAPTPIK3CBALDH1A1SMN1; SMN2DCTPP1
SCHEMBL6300801 0.85 PIK3CB (0.40) MAPTPIK3CBPIK3C2BALDH1A1SMN1; SMN2
SCHEMBL6301216 0.84 PIK3CB (0.42) PIK3CB
SCHEMBL6299841 0.84 MAPT (0.41) MAPTPIK3CBALDH1A1SMN1; SMN2DCTPP1
SCHEMBL6299864 0.83 PIK3CB (0.41) MAPTPIK3CBALDH1A1SMN1; SMN2
SCHEMBL6299323 0.82 MRGPRX4 (0.42) PIK3CB
SCHEMBL6299750 0.82 PTGS2 (0.40) MAPTALDH1A1PPARG
SCHEMBL6300490 0.82 KMT2A (0.43) PIK3CBDCTPP1
SCHEMBL6306845 0.82 PIK3CB (0.40) MAPTPIK3CBPIK3C2BALDH1A1SMN1; SMN2

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
US-6911469-B2 Sulfonamide compounds and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-06-28 US disclosed
US-20040180947-A1 hypoglycemic activity or phoshodiesterase-V inhibitory activity; prophylaxis and treatment of impaired glucose tolerance disorder, diabetes (e.g., type II diabetes), diabetic complications FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-09-16 US disclosed
US-20020099212-A1 For therapy of disease treatable based on a blood sugar level-depressing activity or a disease treatable based on a cGMP-PDE inhibiting activity, smooth muscle relaxing activity, bronchodilating activity, vasodilating activity FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2002-07-25 US disclosed
US-6348474-B1 COMPOUNDS AS ANTIDIABETIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-02-19 US disclosed
EP-0995742-A1 SULFONAMIDE COMPOUNDS AND MEDICINAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-26 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 (2 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-20020099212-A1 For therapy of disease treatable based on a blood sugar level-depressing activity or a disease treatable based on a cGMP-PDE inhibiting activity, smooth muscle relaxing activity, bronchodilating activity, vasodilating activity PDE2A, PDE3A, PDE12 MAPT 4591/4885PIK3CB 1677/4885PIK3C2B 2377/4885
US-20040180947-A1 hypoglycemic activity or phoshodiesterase-V inhibitory activity; prophylaxis and treatment of impaired glucose tolerance disorder, diabetes (e.g., type II diabetes), diabetic complications PDE2A, PDE3A, PYGM MAPT 4725/4885PIK3CB 264/4885PIK3C2B 500/4885

“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.