SCHEMBL6300879

SCHEMBL6300879

COC(=O)c1ccc2c(C)nn(Cc3ccc(Cl)cc3Cl)c2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 7/20 0.58
LMNA P02545 5/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
ALDH1A1 P00352 3/20 0.52
HTT P42858 2/20 0.52
JAK2 O60674 1/20 0.52
TP53 P04637 1/20 0.52
RAB9A P51151 1/20 0.52
KMO O15229 1/20 0.49
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2C9 P11712 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
CYP2D6 P10635 1/20 0.48
TSHR P16473 1/20 0.48
PMP22 Q01453 1/20 0.48
HIF1A Q16665 1/20 0.48
USP2 O75604 1/20 0.45
CYP2C19 P33261 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.45

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
SCHEMBL6299227 0.89 SLC22A12 (0.56) SLC22A12LMNASMN1; SMN2ALDH1A1HTT
SCHEMBL6301450 0.88 SLC22A12 (0.71) SLC22A12LMNASMN1; SMN2ALDH1A1HTT
SCHEMBL6298607 0.87 SLC22A12 (0.54) SLC22A12LMNASMN1; SMN2ALDH1A1HTT
SCHEMBL6301274 0.87 SLC22A12 (0.58) SLC22A12PTGDR2BUB1
SCHEMBL1049050 0.83 CYP1A2 (0.60) SLC22A12LMNASMN1; SMN2ALDH1A1HTT
SCHEMBL1047555 0.82 CYP1A2 (0.61) LMNASMN1; SMN2ALDH1A1HTTJAK2
SCHEMBL1553851 0.81 SLC22A12 (0.58) SLC22A12RAB9AGAA
SCHEMBL1044775 0.80 CYP1A2 (0.56) LMNASMN1; SMN2ALDH1A1HTTJAK2
SCHEMBL6299998 0.80 SLC22A12 (0.52) SLC22A12LMNASMN1; SMN2ALDH1A1HTT
SCHEMBL5881788 0.79 PDE4A (0.53) SLC22A12LMNASMN1; SMN2GAA

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 SLC22A12 822/4885LMNA 1751/4885SMN1; SMN2 186/4885
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 SLC22A12 1685/4885LMNA 1811/4885SMN1; SMN2 1017/4885

“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.