SCHEMBL5881591

SCHEMBL5881591

NS(=O)(=O)c1ccc(N=Nc2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 10/20 0.70
CA9 Q16790 10/20 0.70
CA12 O43570 9/20 0.70
CA7 P43166 3/20 0.68
POLB P06746 2/20 0.64
CYP2D6 P10635 1/20 0.64
CA1 P00915 4/20 0.62
CA3 P07451 1/20 0.62
CA4 P22748 1/20 0.62
CA6 P23280 1/20 0.62
CA5A P35218 1/20 0.62
PLA2G7 Q13093 1/20 0.62
CA13 Q8N1Q1 1/20 0.62
CA14 Q9ULX7 1/20 0.62
CA5B Q9Y2D0 1/20 0.62
PTGS2 P35354 6/20 0.61
PTGS1 P23219 4/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
NPC1 O15118 1/20 0.61

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
SCHEMBL10706744 1.00 CA2 (0.70) CA2CA9CA12CA7POLB
Azobenzene SCHEMBL28217411 0.90 CA2 (0.81) CA2CA9CA12CA7POLB
SCHEMBL28217410 0.89 CA2 (0.65) CA2CA9CA12CA7POLB
Azobenzene SCHEMBL5573397 0.84 ALDH1A1 (0.67) CA2CA9CA12CA7POLB
SCHEMBL10867845 0.83 CA2 (1.00) CA2CA9CA12CA7POLB
SCHEMBL11445876 0.83 CA2 (1.00) CA2CA9CA12CA7POLB
SCHEMBL27094281 0.82 POLB (0.69) CA2CA9CA12CA7POLB
SCHEMBL31060725 0.81 CA2 (1.00) CA2CA9CA12CA7POLB
SCHEMBL29164152 0.80 CA2 (0.78) CA2CA9CA12CA7POLB
Azobenzene SCHEMBL29181662 0.79 POLB (0.65) CA2CA9CA12CA7POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115647-B2 Method of inhibiting neoplastic cells with indole derivatives OSI PHARMACEUTICALS, INC. (US) 2006-10-03 US disclosed
US-20020143022-A1 Method of inhibiting neoplastic cells with indole derivatives OSI PHARMACEUTICALS, INC. 2002-10-03 US disclosed
US-6410584-B1 ANTICANCER AGENTS CELL PATHWAYS, INC. 2002-06-25 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-20020143022-A1 Method of inhibiting neoplastic cells with indole derivatives IDO1, IDO2, INMT CA2 1694/4885CA9 1814/4885CA12 2258/4885

“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.