SCHEMBL2181072

SCHEMBL2181072

CCNC(=O)Nc1nc2c(F)c(-c3cccc(OC(CC)C(=O)O)c3)cc(-c3ncccc3F)c2s1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 3/20 0.39
▸ PLG P00747 2/20 0.39
▸ PLAT P00750 2/20 0.39
▸ FABP4 P15090 1/20 0.38
▸ ABL1 P00519 5/20 0.37
▸ DGAT2 Q96PD7 1/20 0.36

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
SCHEMBL2181228 0.93 PPARG (0.39) ABL1
SCHEMBL1843366 0.89 ABL1 (0.40) PLAUPLGPLATFABP4ABL1
SCHEMBL1843639 0.88 FABP4 (0.38) FABP4ABL1DGAT2
Lithium SCHEMBL1843651 0.88 FABP4 (0.38) FABP4ABL1DGAT2
SCHEMBL1843004 0.86 MAPK1 (0.43) ABL1
SCHEMBL1843794 0.86 ABL1 (0.47) ABL1
Lithium Ion SCHEMBL1843643 0.85 ABL1 (0.38) ABL1DGAT2
SCHEMBL1841608 0.85 NPC1 (0.41) ABL1
SCHEMBL1842538 0.83 ABL1 (0.39) ABL1
SCHEMBL1840274 0.83 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110166088-A1 BENZOTHIAZOLES AND AZA-ANALOGUES THEREOF USE AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2011-07-07 — — US claimed
US-20110166088-A1 BENZOTHIAZOLES AND AZA-ANALOGUES THEREOF USE AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2011-07-07 — — 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-20110166088-A1 BENZOTHIAZOLES AND AZA-ANALOGUES THEREOF USE AS ANTIBACTERIAL AGENTS TOP2B, TOP1, POLI PLAU 992/4885PLG 1859/4885PLAT 380/4885

“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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