SCHEMBL6504639

SCHEMBL6504639

COC(=O)c1ccc2nc(C)n(Cc3ncc(NC(=O)OC(C)C)cc3Cl)c2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.39
NPC1 O15118 3/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
RAB9A P51151 2/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
AGPAT2 O15120 1/20 0.35
ALOX15 P16050 1/20 0.35
LMNA P02545 2/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
KMT2A Q03164 1/20 0.33
TUBB4A P04350 1/20 0.33
TUBB P07437 1/20 0.33
TUBA3C P0DPH7 1/20 0.33
TUBA1B P68363 1/20 0.33
TUBA4A P68366 1/20 0.33
TUBB4B P68371 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
SCHEMBL6491426 0.92 SMN1; SMN2 (0.36) HPGDNPC1KDM4EALDH1A1HSD17B10
SCHEMBL6501157 0.90 ALDH1A1 (0.39) HPGDNPC1KDM4EALDH1A1RAB9A
SCHEMBL6500785 0.88 NPC1 (0.38) HPGDNPC1KDM4EALDH1A1RAB9A
SCHEMBL6502802 0.86 SMN1; SMN2 (0.43) HPGDNPC1KDM4EALDH1A1RAB9A
SCHEMBL6492195 0.84 PTGS2 (0.38) ALDH1A1AGPAT2SMN1; SMN2KMT2ATUBB4A
SCHEMBL6491659 0.83 MRGPRX4 (0.39) HPGDNPC1KDM4EALDH1A1RAB9A
SCHEMBL6491948 0.83 PPARG (0.44) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL6493424 0.82 SCN9A (0.36) HPGDNPC1KDM4EALDH1A1HSD17B10
SCHEMBL6491421 0.82 SCN9A (0.36) HPGDNPC1KDM4EALDH1A1HSD17B10
SCHEMBL6491410 0.81 ALDH1A1 (0.39) HPGDNPC1KDM4EALDH1A1RAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6890934-B2 Sulfonamide compounds and uses thereof as medicines FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-05-10 US disclosed
US-20030171396-A1 Sulfonamide compounds and uses thereof as medicines FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2003-09-11 US disclosed
US-6573274-B1 Treatment of the diseases curable based on a hypoglycemic action, and the diseases curable based on a cGMP-PDE inhibitory action, a smooth muscle relaxing action, a bronchodilating action, a vasodilating action, a smooth muscle FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2003-06-03 US disclosed
EP-1136492-A1 SULFONAMIDE COMPOUNDS AND USES THEREOF AS MEDICINES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-09-26 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 (1 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-20030171396-A1 Sulfonamide compounds and uses thereof as medicines PDE2A, PDE3A, PDE5A HPGD 1182/4885NPC1 4422/4885KDM4E 1599/4885

“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.