SCHEMBL6301307

SCHEMBL6301307

CCCc1cc2cc(Br)ccc2o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.49
CYP2A6 P11509 1/20 0.46
PIM1 P11309 1/20 0.45
USP2 O75604 1/20 0.44
MAOA P21397 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
F2 P00734 1/20 0.42
F10 P00742 1/20 0.42
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GPR35 Q9HC97 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
ADAM17 P78536 1/20 0.41
ALDH2 P05091 1/20 0.41
ALDH1A3 P47895 1/20 0.41
CA12 O43570 1/20 0.41

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
SCHEMBL2333763 0.90 CYP19A1 (0.47) CYP19A1CYP2A6PIM1USP2MAOA
SCHEMBL7469284 0.88 ALOX15 (0.47) CYP19A1CYP2A6PIM1USP2MAOA
SCHEMBL7463986 0.87 MAPT (0.48) CYP19A1CYP2A6PIM1USP2MAOA
SCHEMBL30317998 0.85 CYP19A1 (0.51) CYP19A1CYP2A6PIM1USP2MAOA
SCHEMBL6300586 0.85 CYP19A1 (0.51) CYP19A1CYP2A6PIM1USP2MAOA
SCHEMBL8950010 0.83 ALDH1A1 (0.50) CYP19A1CYP2A6PIM1USP2MAOA
SCHEMBL2788486 0.82 CYP19A1 (0.49) CYP19A1CYP2A6PIM1USP2MAOA
SCHEMBL8950183 0.82 CYP19A1 (0.49) CYP19A1CYP2A6PIM1MAOANPC1
SCHEMBL119526 0.81 CYP19A1 (0.51) CYP19A1CYP2A6PIM1USP2MAOA
SCHEMBL14756120 0.81 CYP19A1 (0.46) CYP19A1CYP2A6PIM1USP2MAOA

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 CYP19A1 2703/4885CYP2A6 2323/4885PIM1 1968/4885
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 CYP19A1 1971/4885CYP2A6 1717/4885PIM1 2861/4885

“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.