SCHEMBL6740841

SCHEMBL6740841

CS(=O)(=O)C1Cc2ccccc2C1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
ALDH1A1 P00352 2/20 0.41
PSEN1 P49768 6/20 0.39
PSEN2 P49810 6/20 0.39
APH1B Q8WW43 6/20 0.39
NCSTN Q92542 6/20 0.39
APH1A Q96BI3 6/20 0.39
PSENEN Q9NZ42 6/20 0.39
IDO1 P14902 2/20 0.38
ACHE P22303 1/20 0.38
AKR1C3 P42330 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL15172181 0.86 AKR1C3 (0.49) CA1CA2AKR1C3
SCHEMBL8563961 0.77 MTNR1A (0.46) CA1CA2ALDH1A1
SCHEMBL8563958 0.77 MTNR1A (0.46) CA1CA2ALDH1A1
SCHEMBL8563956 0.77 MTNR1A (0.46) CA1CA2ALDH1A1
SCHEMBL22265257 0.76 CA1 (0.55) CA1CA2PSEN1PSEN2APH1B
SCHEMBL6374701 0.76 CA1 (0.45) CA1CA2ALDH1A1PSEN1PSEN2
SCHEMBL7762830 0.76 CA1 (0.45) CA1CA2ALDH1A1PSEN1PSEN2
SCHEMBL31443393 0.76 CA1 (0.55) CA1CA2PSEN1PSEN2APH1B
SCHEMBL29593055 0.76 CA1 (0.45) CA1CA2ALDH1A1PSEN1PSEN2
SCHEMBL30137235 0.76 CA1 (0.41) CA1CA2ALDH1A1PSEN1PSEN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates SMITHKLINE BEECHAM P.L.C. 2004-11-11 US disclosed
US-20030199571-A1 (Hetero) Bicyclymethanesulfonylamino-substituted hydroxamic acid derivatives SMITHKLINE BEECHAM P.L.C. (GB) 2003-10-23 US 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-20030199571-A1 (Hetero) Bicyclymethanesulfonylamino-substituted hydroxamic acid derivatives CD40, CD22, CD2 CA1 189/4885CA2 673/4885ALDH1A1 350/4885
US-20040225006-A1 (Hetero) bicyclymethanesulfonylamino-substituted hydroxamic acid derivates CD40, TNFRSF1A, CD2 CA1 219/4885CA2 1138/4885ALDH1A1 139/4885

“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.