SCHEMBL6301370

SCHEMBL6301370

CNC(=O)c1ccc2c(=O)n(C)c(Cc3ccc(Cl)cc3Cl)nc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
IP6K1 Q92551 1/20 0.43
HDAC8 Q9BY41 2/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
KCNH2 Q12809 1/20 0.43
MAPT P10636 3/20 0.41
RXFP1 Q9HBX9 1/20 0.41
CYP3A4 P08684 2/20 0.41
POLB P06746 3/20 0.40
TP53 P04637 2/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
LMNA P02545 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL401474 0.89 MBOAT4 (0.46) NPC1RAB9AMAPTCYP3A4POLB
SCHEMBL6299260 0.84 PPARG (0.55) NPC1RAB9AHDAC8MAPTRXFP1
SCHEMBL404057 0.73 PDE5A (0.61) HDAC8MAPTCYP3A4HDAC1HDAC6
SCHEMBL403865 0.73 ALDH1A1 (0.48) HDAC8MAPTCYP3A4ALDH1A1SMN1; SMN2
SCHEMBL31542051 0.71 HDAC6 (0.66) HDAC8KCNH2CYP3A4HDAC1HDAC6
SCHEMBL8614149 0.70 HDAC6 (0.70) HDAC8RXFP1CYP3A4ALDH1A1HDAC6
SCHEMBL1161394 0.70 CYP3A4 (0.51) RXFP1CYP3A4
SCHEMBL2315906 0.68 HDAC6 (0.59) RAB9AHDAC8SMN1; SMN2HDAC1HDAC6
SCHEMBL2117506 0.67 CYP3A4 (0.53) NPC1RAB9AHDAC8CYP3A4SMN1; SMN2
SCHEMBL28097941 0.66 CYP3A4 (0.62) MAPTRXFP1CYP3A4ALDH1A1

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 NPC1 4449/4885RAB9A 2759/4885IP6K1 852/4885
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 NPC1 4845/4885RAB9A 3000/4885IP6K1 374/4885

“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.