SCHEMBL11930741

SCHEMBL11930741

CC(=O)Nc1nnc(S(=O)(=O)NC(C)=O)s1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 13/20 0.76
▸ CA2 P00918 13/20 0.76
▸ CA9 Q16790 9/20 0.76
▸ CA4 P22748 7/20 0.76
▸ CA12 O43570 3/20 0.76
▸ CA3 P07451 3/20 0.76
▸ CA6 P23280 3/20 0.76
▸ CA5A P35218 3/20 0.76
▸ CA7 P43166 3/20 0.76
▸ CA13 Q8N1Q1 3/20 0.76
▸ CA14 Q9ULX7 3/20 0.76
▸ CA5B Q9Y2D0 3/20 0.76
▸ KMT2A Q03164 3/20 0.68
▸ MEN1 O00255 2/20 0.68
▸ CA11 O75493 1/20 0.68
▸ THRB P10828 1/20 0.68
▸ BLM P54132 1/20 0.68
▸ SMN1; SMN2 Q16637 1/20 0.68
▸ TDP1 Q9NUW8 1/20 0.68
▸ GLS O94925 1/20 0.44

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
SCHEMBL10797173 0.86 CA1 (1.00) CA1CA2CA9CA4CA12
SCHEMBL9885775 0.86 CA1 (0.70) CA1CA2CA9CA4CA12
SCHEMBL17320001 0.85 CA1 (0.56) CA1CA2CA9CA4CA12
SCHEMBL18100211 0.82 CA1 (0.72) CA1CA2CA9CA4CA12
SCHEMBL11929008 0.82 CA1 (0.69) CA1CA2CA9CA4CA12
SCHEMBL13711902 0.82 CA1 (0.69) CA1CA2CA9CA4CA12
SCHEMBL3501152 0.82 CA1 (0.69) CA1CA2CA9CA4CA12
SCHEMBL6448329 0.81 CA1 (0.59) CA1CA2CA9CA4CA12
SCHEMBL6448327 0.81 CA1 (0.59) CA1CA2CA9CA4CA12
SCHEMBL18656466 0.81 CA1 (0.68) CA1CA2CA9CA4CA12

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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9796696-B2 Substituted arylcyclopentenes as therapeutic agents ALLERGAN, INC. (US) 2017-10-24 — — US disclosed
EP-2027081-B1 THERAPEUTIC PROSTAGLANDIN COMPOUNDS FOR THE TREATMENT OF GLAUCOMA ALLERGAN INC (US) 2017-05-03 — — EP disclosed
US-9365485-B2 Substituted arylcyclopentenes as therapeutic agents ALLERGAN, INC. (US) 2016-06-14 — — US disclosed
EP-2046714-B1 Cyclopentane derivatives as antiglaucoma agents ALLERGAN INC (US) 2015-12-09 — — EP disclosed
US-20150274658-A1 THERAPEUTIC LACTAMS ALLERGAN, INC. (US) 2015-10-01 — — US disclosed
US-20140323510-A1 SUBSTITUTED ARYLCYCLOPENTENES AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2014-10-30 — — US disclosed
US-8722726-B2 Substituted arylcyclopentenes as therapeutic agents ALLERGAN, INC. (US) 2014-05-13 — — US disclosed
EP-2019820-B1 THERAPEUTIC PYRROLIDINE COMPOUNDS ALLERGAN INC (US) 2012-11-21 — — EP disclosed
EP-2114875-B1 SUBSTITUTED ARYLCYLOPENTENES AS THERAPEUTIC AGENTS ALLERGAN INC (US) 2012-08-15 — — EP disclosed
US-8039496-B2 Therapeutic compounds ALLERGAN, INC. (US) 2011-10-18 — — US disclosed
WO-2007140197-A1 THERAPEUTIC PYRROLIDINE COMPOUNDS ALLERGAN, INC. (US) 2007-12-06 — — WO disclosed
WO-2007140136-A2 THERAPEUTIC CYCLOPENTANE DERIVATIVES ALLERGAN, INC. (US) 2007-12-06 — — WO disclosed
US-20070270387-A1 THERAPEUTIC CYCLOPENTANE DERIVATIVES ALLERGAN, INC 2007-11-22 — — US disclosed
WO-2007134085-A2 ISOTHIAZOLIDINES USEFUL IN THE TREATMENT OF OCULAR HYPERTENSIVE CONDITIONS ALLERGAN, INC. (US) 2007-11-22 — — WO disclosed
WO-2007131012-A1 12-ARYL OR HETEROARYL PROSTAGLANDIN ANALOGS ALLERGAN, INC. (US) 2007-11-15 — — WO disclosed
WO-2007130902-A2 THERAPEUTIC CYCLOPENTANE DERIVATIVES ALLERGAN, INC. (US) 2007-11-15 — — WO disclosed
WO-2007130890-A2 CYCLOPENTANE-DERIVATIVES AND THEIR USE AS OCULAR HYPOTENSIVE AGENTS ALLERGAN, INC. (US) 2007-11-15 — — WO disclosed
US-20070259947-A1 THERAPEUTIC COMPOUNDS ALLERGAN, INC. 2007-11-08 — — US disclosed
US-20070259836-A1 THERAPEUTIC CYCLOPENTANE DERIVATIVES ALLERGAN, INC. 2007-11-08 — — US disclosed
WO-2007115020-A2 THERAPEUTIC PROSTAGLANDIN COMPOUNDS FOR THE TREATMENT OF GLAUCOMA ALLERGAN, INC. (US) 2007-10-11 — — 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 (5 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-20070259836-A1 THERAPEUTIC CYCLOPENTANE DERIVATIVES PTGIS, PTGIR, CYP11B2 CA1 1225/4885CA2 125/4885CA9 720/4885
US-20150274658-A1 THERAPEUTIC LACTAMS CLPP, NOTUM, PEPD CA1 3777/4885CA2 3810/4885CA9 1857/4885
US-20140323510-A1 SUBSTITUTED ARYLCYCLOPENTENES AS THERAPEUTIC AGENTS ABCB1, THPO, UGT2B7 CA1 4344/4885CA2 3900/4885CA9 3681/4885
US-20070259947-A1 THERAPEUTIC COMPOUNDS GOT2, ANXA5, MMP8 CA1 3439/4885CA2 2527/4885CA9 2024/4885
US-20070270387-A1 THERAPEUTIC CYCLOPENTANE DERIVATIVES ABCB1, CYP11B2, SLC10A1 CA1 357/4885CA2 97/4885CA9 472/4885

“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.

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