SCHEMBL2179168

SCHEMBL2179168

CCNC(=O)Nc1nc2c(F)c(-c3cccnc3N3CCNCC3)cc(-c3ccccn3)c2s1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 1/20 0.40
▸ TYRO3 Q06418 1/20 0.40
▸ MERTK Q12866 1/20 0.40
▸ GAS6 Q14393 1/20 0.40
▸ ABL1 P00519 6/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HTR7 P34969 1/20 0.38
▸ USP28 Q96RU2 1/20 0.37
▸ USP25 Q9UHP3 1/20 0.37
▸ HDAC1 Q13547 2/20 0.37
▸ HDAC2 Q92769 2/20 0.37
▸ SCN9A Q15858 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
SCHEMBL1843018 0.87 ABL1 (0.39) FLT3TYRO3MERTKGAS6ABL1
Hydrochloric Acid SCHEMBL1843261 0.86 ABL1 (0.38) FLT3TYRO3MERTKGAS6ABL1
SCHEMBL1844044 0.86 HDAC2 (0.45) FLT3TYRO3MERTKGAS6ABL1
Hydrochloric Acid SCHEMBL1854779 0.80 NPC1 (0.40) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL1841588 0.79 — —
SCHEMBL1842825 0.79 ABL1 (0.44) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL1842109 0.78 MAPK1 (0.43) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL1684077 0.78 NPC1 (0.47) ABL1NPC1RAB9ASMN1; SMN2
SCHEMBL1708351 0.78 NPC1 (0.47) ABL1NPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL1841784 0.78 AXL (0.44) FLT3TYRO3MERTKGAS6ABL1

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 FLT3 2740/4885TYRO3 4601/4885MERTK 3519/4885

“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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