SCHEMBL7063152

SCHEMBL7063152

CCC(NC(=O)OC(C)(C)C)C(O)N(C)C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA7 P43166 2/20 0.50
CTSK P43235 10/20 0.43
CTSS P25774 3/20 0.43
CYP2D6 P10635 1/20 0.42
CA4 P22748 1/20 0.39
CA9 Q16790 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HTT P42858 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
SCHEMBL21729511 0.82 CA1 (0.56) CA1CA2CA7CTSKCTSS
SCHEMBL26405353 0.82 CA1 (0.56) CA1CA2CA7CTSKCTSS
SCHEMBL14923548 0.81 CA1 (0.54) CA1CA2CA7CTSKCTSS
SCHEMBL15081309 0.81 CA1 (0.59) CA1CA2CA7CTSKCTSS
SCHEMBL20442832 0.81 CA1 (0.59) CA1CA2CA7CTSKCTSS
SCHEMBL24669522 0.81 CA1 (0.59) CA1CA2CA7CTSKCTSS
SCHEMBL19546156 0.81 CA1 (0.59) CA1CA2CA7CTSKCTSS
SCHEMBL14980856 0.81 CA1 (0.54) CA1CA2CA7CTSKCTSS
SCHEMBL3389500 0.81 CA1 (0.59) CA1CA2CA7CTSKCTSS
SCHEMBL1134626 0.79 CA1 (0.53) CA1CA2CA7CTSKCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030139409-A1 Benzo[A] [phenazin-11-carboxamide derivatives and their use as joint inhibitors of topomerase I and II XENOVA LIMITED (GB) 2003-07-24 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-20030139409-A1 Benzo[A] [phenazin-11-carboxamide derivatives and their use as joint inhibitors of topomerase I and II TOP1, TOP2A, TOP2B CA1 457/4885CA2 302/4885CA7 284/4885

“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.