SCHEMBL1843025

SCHEMBL1843025

CCNC(=O)Nc1nc2c(F)c(-c3cnc(N(C)CC(=O)O)nc3)cc(-c3ccccn3)c2s1.[LiH]

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 7/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ FGFR1 P11362 1/20 0.35
▸ SRC P12931 1/20 0.35

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
Lithium SCHEMBL1843044 0.98 ABL1 (0.38) ABL1NPC1RAB9ASMN1; SMN2FGFR1
Lithium Ion SCHEMBL1843029 0.92 ABL1 (0.38) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL2181223 0.90 ABL1 (0.38) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL1847763 0.88 ABL1 (0.36) ABL1
Lithium SCHEMBL1847772 0.87 ABL1 (0.36) ABL1
SCHEMBL1843460 0.86 ABL1 (0.39) ABL1NPC1RAB9ASMN1; SMN2FGFR1
SCHEMBL1842847 0.85 ABL1 (0.43) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL1841659 0.84 NPC1 (0.43) ABL1NPC1RAB9ASMN1; SMN2
Lithium SCHEMBL1843487 0.84 ABL1 (0.39) ABL1NPC1RAB9ASMN1; SMN2FGFR1
SCHEMBL1842825 0.83 ABL1 (0.44) ABL1NPC1RAB9ASMN1; SMN2

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 4 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
EP-2321309-A1 BENZOTHIAZOLES AND AZA-ANALOGUES THEREOF USE AS ANTIBACTERIAL AGENTS Ranbaxy Laboratories Limited (IN) 2011-05-18 — — EP disclosed
WO-2009156966-A1 BENZOTHIAZOLES AND AZA-ANALOGUES THEREOF USE AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2009-12-30 — — 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 (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 ABL1 1206/4885NPC1 3448/4885RAB9A 3428/4885

“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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