SCHEMBL5424951

SCHEMBL5424951

N#Cc1ccc(S(=O)(=O)N2CCCC3(CCN(c4ccc(Cl)cc4)C3=O)C2)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 17/20 0.46
CYP3A4 P08684 3/20 0.45
KCNH2 Q12809 3/20 0.45
TRPM8 Q7Z2W7 1/20 0.45
LIPE Q05469 1/20 0.41
CYP19A1 P11511 1/20 0.41
HSD11B1 P28845 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
SCHEMBL5425143 0.92 LIPE (0.43) TRPV4CYP3A4KCNH2TRPM8LIPE
SCHEMBL5438850 0.89 HSD11B1 (0.41) TRPV4CYP3A4KCNH2TRPM8CYP19A1
SCHEMBL5421695 0.87 USP2 (0.45) TRPV4CYP3A4HSD11B1
SCHEMBL5422092 0.87 TRPV4 (0.46) TRPV4CYP3A4KCNH2TRPM8
SCHEMBL5431215 0.86 TRPV4 (0.45) TRPV4CYP3A4KCNH2TRPM8
SCHEMBL5437244 0.85 LIPE (0.46) TRPV4LIPE
SCHEMBL5431071 0.81 CYP3A4 (0.46) CYP3A4CYP19A1
SCHEMBL5423744 0.80 L3MBTL1 (0.46) CYP3A4LIPEHSD11B1
SCHEMBL5425193 0.79 SLC13A5 (0.40) CYP3A4LIPEHSD11B1
SCHEMBL5421659 0.77 MAPT (0.44) CYP3A4

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-20070275990-A1 Heterocyclic Spiro Compound ONO PHARMACEUTICAL CO., LTD. 2007-11-29 US claimed
EP-1683797-A1 HETEROCYCLIC SPIRO COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2006-07-26 EP claimed
US-20070275990-A1 Heterocyclic Spiro Compound ONO PHARMACEUTICAL CO., LTD. 2007-11-29 US disclosed
EP-1683797-A1 HETEROCYCLIC SPIRO COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2006-07-26 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-20070275990-A1 Heterocyclic Spiro Compound NR3C2, CBR1, CBR3 TRPV4 3352/4885CYP3A4 888/4885KCNH2 2815/4885

“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.