SCHEMBL5483019

SCHEMBL5483019

CC(C)c1cccc(NS(=O)(=O)N2CCN(c3ccc(C#N)cn3)CC2)n1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.51
PANK3 Q9H999 7/20 0.46
GPR119 Q8TDV5 1/20 0.44
PARP1 P09874 2/20 0.40
SMO Q99835 1/20 0.40
PARP2 Q9UGN5 1/20 0.39
CHRM1 P11229 1/20 0.38

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
SCHEMBL5466689 0.87 HSD11B1 (0.48) HSD11B1PANK3GPR119PARP1SMO
SCHEMBL5468420 0.85 HSD11B1 (0.48) HSD11B1PANK3GPR119SMOCHRM1
SCHEMBL5468233 0.84 HSD11B1 (0.51) HSD11B1PANK3GPR119PARP1SMO
SCHEMBL14581841 0.83 HSD11B1 (0.45) HSD11B1PANK3GPR119PARP1SMO
SCHEMBL14581827 0.83 HSD11B1 (0.49) HSD11B1CHRM1
SCHEMBL5481967 0.82 HSD11B1 (0.51) HSD11B1PANK3GPR119PARP1SMO
SCHEMBL14581838 0.81 HSD11B1 (0.48) HSD11B1PANK3GPR119PARP1SMO
SCHEMBL14581819 0.80 KDM4E (0.52) HSD11B1PANK3GPR119PARP1SMO
SCHEMBL5466940 0.78 PANK3 (0.40) HSD11B1PANK3GPR119SMOCHRM1
SCHEMBL12640412 0.78 HSD11B1 (0.49) HSD11B1PANK3GPR119PARP1SMO

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-20070027118-A1 Novel compounds of amino sulfonyl derivatives AGOURON PHARMACEUTICALS, INC 2007-02-01 US disclosed
US-20070027118-A1 Novel compounds of amino sulfonyl derivatives AGOURON PHARMACEUTICALS, INC 2007-02-01 US disclosed
US-20070027118-A1 Novel compounds of amino sulfonyl derivatives AGOURON PHARMACEUTICALS, INC 2007-02-01 US disclosed
WO-2006106423-A2 AMINO SULFONYL DERIVATIVES AS INHIBITORS OF HUMAN 11-.BETA.-HYDROSYSTEROID DEHYDROGENASE PFIZER INC. (US) 2006-10-12 WO 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-20070027118-A1 Novel compounds of amino sulfonyl derivatives HSD11B1, HSD11B2, HSD17B11 HSD11B1 1/4885PANK3 2984/4885GPR119 29/4885

“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.