SCHEMBL1656972

SCHEMBL1656972

C=C(C)Cc1c(NCc2ccco2)nc(-c2ccc(Cl)c(F)c2)nc1C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ F2 P00734 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ APP P05067 1/20 0.38
▸ MAPT P10636 4/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ LMNA P02545 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ SOS1 Q07889 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ TSHR P16473 1/20 0.37

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
SCHEMBL1608896 0.87 APP (0.42) NPC1RAB9AF2NPSR1APP
SCHEMBL11913405 0.84 APP (0.40) NPC1RAB9AF2NPSR1APP
SCHEMBL11903069 0.82 HTT (0.45) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL11903228 0.82 APP (0.38) NPC1RAB9AF2NPSR1APP
SCHEMBL11903231 0.82 APP (0.38) NPC1RAB9AF2NPSR1APP
SCHEMBL1656970 0.80 MAPT (0.32) NPSR1MAPTLMNAHTTSMN1; SMN2
SCHEMBL1610660 0.80 SOS1 (0.44) NPC1RAB9AF2NPSR1APP
SCHEMBL12713367 0.79 MAPT (0.43) NPC1RAB9AF2NPSR1APP
SCHEMBL1610398 0.79 MAPT (0.43) NPC1RAB9AF2NPSR1APP
SCHEMBL1610506 0.79 MAPT (0.44) NPC1RAB9AF2NPSR1APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488518-A2 HERBICIDAL COMPOUNDS Syngenta Limited (GB) 2012-08-22 — — EP disclosed
US-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — US disclosed
US-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — US disclosed
US-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — US disclosed
WO-2011045561-A2 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2011-04-21 — — WO disclosed
WO-2011045561-A2 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2011-04-21 — — 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-20120202690-A1 HERBICIDAL COMPOUNDS DDT, HAO2, HAAO NPC1 3913/4885RAB9A 2839/4885F2 4731/4885

“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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