SCHEMBL7100550

SCHEMBL7100550

CN(C)S(=O)(=O)n1cnc(C(O)c2cccc(N)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
HTT P42858 1/20 0.33
CPN1 P15169 1/20 0.32
CPB2 Q96IY4 1/20 0.32
OPRK1 P41145 2/20 0.32
OPRD1 P41143 4/20 0.31
AURKA O14965 2/20 0.31
RPS6KB1 P23443 2/20 0.31
TSHR P16473 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
SORD Q00796 2/20 0.31

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
SCHEMBL7098632 0.88 CA1 (0.32) CA1CA2CA9HTTAURKA
SCHEMBL31040271 0.86 HTT (0.36) HTTALDH1A1SORD
SCHEMBL7100452 0.83 KMT2A (0.44) HTTOPRK1ALDH1A1
SCHEMBL3747956 0.82 UGT2B7 (0.39) TSHR
SCHEMBL7166942 0.75 MEN1 (0.38) HTTTSHRALDH1A1TDP1
SCHEMBL31040273 0.75 CA12 (0.42) CA1CA2CA9HTTTSHR
SCHEMBL31531675 0.74 HTT (0.40) HTTTSHRSORD
SCHEMBL4828602 0.74 IDO1 (0.37) HTTTSHRALDH1A1HSD17B10
SCHEMBL7252794 0.74 CA1 (0.39) CA1CA2CA9OPRK1
SCHEMBL9876151 0.73 HTT (0.36) HTTALDH1A1

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-20030073850-A1 4-Imidazole derivatives of benzyl and restricted benzyl sulfonamides, sulfamides, ureas, carbamates, and amides and their use ABBOTT LABORATORIES 2003-04-17 US disclosed
US-6503935-B1 Treating urinary incontinence or retrograde ejaculation ABBOTT LABORATORIES 2003-01-07 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 (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-20030073850-A1 4-Imidazole derivatives of benzyl and restricted benzyl sulfonamides, sulfamides, ureas, carbamates, and amides and their use ADRA1D, ADRB1, ADRA1A CA1 2378/4885CA2 1314/4885CA9 3752/4885

“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.