SCHEMBL6725627

SCHEMBL6725627

O=C(Oc1ncc(-c2ccncc2)cn1)N1CCN(S(=O)(=O)N2Cc3cc(Cl)ccc3C2=O)CC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 9/20 0.36
CYP11B1 P15538 8/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
F10 P00742 1/20 0.35
FNTA P49354 6/20 0.34
FNTB P49356 6/20 0.34
MGLL Q99685 1/20 0.33
SLC6A15 Q9H2J7 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
SCHEMBL6737705 0.85 ALDH1A1 (0.37) ALDH1A1MAPTF10FNTAFNTB
SCHEMBL6730709 0.82 LSS (0.49) ALDH1A1
SCHEMBL6726423 0.75 MAPT (0.37) CYP11B2ALDH1A1MAPTF10FNTA
SCHEMBL6729950 0.74 AKR1C3 (0.44) CYP11B1MAPTFNTAFNTB
SCHEMBL6730820 0.72 ALDH1A1 (0.38) ALDH1A1MAPTF10
SCHEMBL6726196 0.72 F10 (0.41) CYP11B1ALDH1A1MAPTF10
SCHEMBL6735885 0.71 F10 (0.41) ALDH1A1MAPTF10MGLL
SCHEMBL6732153 0.70 ALDH1A1 (0.37) ALDH1A1MAPTF10
SCHEMBL6728488 0.70 ALDH1A1 (0.38) ALDH1A1MAPTF10
SCHEMBL6725420 0.69 ALDH1A1 (0.38) ALDH1A1MAPTF10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6747023-B1 INHIBITORS FOR ACTIVATED COAGULATION FACTOR X, COAGULATION SUPPRESSORS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-06-08 US disclosed
US-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-29 US disclosed
EP-1104754-A1 NOVEL SULFONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-06-06 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-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction F2, CYC1, SULT2A1 CYP11B2 131/4885CYP11B1 169/4885ALDH1A1 1316/4885

“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.