SCHEMBL6299299

SCHEMBL6299299

COC(=O)c1ccc2sc(C)c(Cc3ccc4ccccc4c3Br)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.43
HDAC1 Q13547 1/20 0.39
NQO2 P16083 1/20 0.38
PFKFB3 Q16875 1/20 0.37
PFKFB4 Q16877 1/20 0.37
CMA1 P23946 1/20 0.37
HPGD P15428 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GABRA1 P14867 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
ALDH1A1 P00352 3/20 0.36
KIF11 P52732 1/20 0.36
MAPT P10636 3/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
NCEH1 Q6PIU2 2/20 0.35
ROCK1 Q13464 1/20 0.35
P4HB P07237 1/20 0.35
LMNA P02545 2/20 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
SCHEMBL6301167 0.89 KDM4E (0.38) HPGDSMN1; SMN2GABRA1GABRG2GABRB3
SCHEMBL6300212 0.80 HDAC1 (0.41) GPR84HDAC1NQO2PFKFB3PFKFB4
SCHEMBL6301214 0.80 PDE3B (0.47) GPR84PFKFB3PFKFB4CMA1HPGD
SCHEMBL5882307 0.80 GPR84 (0.50) GPR84HPGDSMN1; SMN2ALDH1A1KIF11
SCHEMBL6298603 0.79 PPARG (0.39) HDAC1NQO2RAB9ANCEH1
SCHEMBL6299179 0.79 PFKFB3 (0.45) GPR84HDAC1PFKFB3PFKFB4CMA1
SCHEMBL6305130 0.78 HDAC1 (0.40) GPR84HDAC1NQO2PFKFB3PFKFB4
SCHEMBL6305899 0.77 EGFR (0.41) GPR84PFKFB3PFKFB4CMA1SMN1; SMN2
SCHEMBL6301947 0.77 MAPT (0.43) GPR84PFKFB3PFKFB4CMA1ALDH1A1
SCHEMBL6299690 0.77 CMA1 (0.45) PFKFB3PFKFB4CMA1SMN1; SMN2MAPT

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 GPR84 609/4885HDAC1 588/4885NQO2 1447/4885
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 GPR84 1821/4885HDAC1 549/4885NQO2 742/4885

“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.