SCHEMBL15317870

SCHEMBL15317870

NS(=O)(=O)c1ccc(N/N=C2\C(=O)Nc3ccc(Br)cc32)cc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 17/20 0.66
▸ CA12 O43570 13/20 0.66
▸ CA9 Q16790 13/20 0.66
▸ CA2 P00918 16/20 0.62
▸ CA4 P22748 2/20 0.62
▸ CA7 P43166 2/20 0.62
▸ EIF2AK2 P19525 1/20 0.51
▸ KDR P35968 1/20 0.50
▸ TGM2 P21980 1/20 0.47
▸ CES1 P23141 1/20 0.47

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
SCHEMBL5427496 0.91 CA1 (0.54) CA1CA12CA9CA2CA4
SCHEMBL5427493 0.91 CA1 (0.54) CA1CA12CA9CA2CA4
SCHEMBL5183261 0.90 CA1 (0.58) CA1CA12CA9CA2CA4
SCHEMBL5419122 0.90 CA1 (0.58) CA1CA12CA9CA2CA4
SCHEMBL5425595 0.88 CA1 (0.52) CA1CA12CA9CA2CA4
SCHEMBL5168743 0.88 CA1 (0.54) CA1CA12CA9CA2CA4
SCHEMBL5427735 0.88 CA1 (0.54) CA1CA12CA9CA2CA4
SCHEMBL5425596 0.88 CA1 (0.52) CA1CA12CA9CA2CA4
Gw280670X SCHEMBL14040830 0.87 CA1 (0.70) CA1CA12CA9CA2CA4
SCHEMBL6620150 0.87 CA1 (0.54) CA1CA12CA9CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180127365-A1 C5, C6 SUBSTITUTED AND/OR FUSED OXINDOLES AS ANTI-CANCER AGENTS AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2018-05-10 — — US disclosed
US-20180000771-A1 AGENT FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS KYOTO UNIVERSITY (JP) 2018-01-04 — — US disclosed
US-8778643-B2 Methods for increasing lipid levels and producing triacylglycerols in algae THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-07-15 — — US disclosed
US-8778643-B2 Methods for increasing lipid levels and producing triacylglycerols in algae THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-07-15 — — US disclosed
US-20130273620-A1 METHODS FOR ALTERING LIPIDS IN ALGAE AND YEAST THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2013-10-17 — — US disclosed
US-20130273620-A1 METHODS FOR ALTERING LIPIDS IN ALGAE AND YEAST THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2013-10-17 — — 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-20180000771-A1 AGENT FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS WEE2, WEE1, ERBB2 CA1 4381/4885CA12 4753/4885CA9 4597/4885
US-20180127365-A1 C5, C6 SUBSTITUTED AND/OR FUSED OXINDOLES AS ANTI-CANCER AGENTS AND PROCESS FOR PREPARATION THEREOF CCNH, C5, CCNI CA1 2082/4885CA12 1710/4885CA9 639/4885

“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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