SCHEMBL11903334

SCHEMBL11903334

CCOC(=O)c1nc(-c2ccc(Cl)c(OC)c2F)nc2[nH]cc(C)c12

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 8/20 0.38
▸ JAK2 O60674 6/20 0.38
▸ MEP1B Q16820 1/20 0.34
▸ GLP1R P43220 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ NPSR1 Q6W5P4 2/20 0.32
▸ METTL3 Q86U44 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ XBP1 P17861 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ TLR9 Q9NR96 1/20 0.32

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
SCHEMBL11902410 0.93 SMN1; SMN2 (0.34) JAK3JAK2MEP1BALDH1A1SMN1; SMN2
SCHEMBL1654718 0.92 TAS1R3 (0.34) MEP1BKMT2AALDH1A1HSD17B10
SCHEMBL11902785 0.90 SMN1; SMN2 (0.40) ALDH1A1SMN1; SMN2MAPT
SCHEMBL11903222 0.90 SMN1; SMN2 (0.34) JAK3JAK2MEP1BKMT2AALDH1A1
SCHEMBL11903387 0.89 DHODH (0.36) KMT2ASMN1; SMN2HSD17B10
SCHEMBL11902933 0.89 SMN1; SMN2 (0.34) MEP1BKMT2AALDH1A1SMN1; SMN2
SCHEMBL11913425 0.89 SMN1; SMN2 (0.39) JAK3JAK2MEP1BKMT2AALDH1A1
SCHEMBL11902404 0.88 L3MBTL1 (0.32) JAK3JAK2MEP1B
SCHEMBL11903416 0.88 SMN1; SMN2 (0.32) JAK3JAK2ALDH1A1SMN1; SMN2
SCHEMBL1654720 0.88 KMO (0.41) MEP1BMEN1KMT2AALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 JAK3 3899/4885JAK2 3622/4885MEP1B 2906/4885

“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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