SCHEMBL11903242

SCHEMBL11903242

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

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL11903327 0.90 SMN1; SMN2 (0.33) ALDH1A1SMN1; SMN2KMT2A
SCHEMBL11903414 0.88 SMN1; SMN2 (0.36) ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL11903085 0.87 MAPT (0.34) ALDH1A1MAPTSMN1; SMN2KDM4EKMT2A
SCHEMBL11902404 0.86 L3MBTL1 (0.32) L3MBTL1
SCHEMBL11902785 0.86 SMN1; SMN2 (0.40) ALDH1A1MAPTSMN1; SMN2L3MBTL1
SCHEMBL11903334 0.84 JAK3 (0.38) ALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL1654718 0.84 TAS1R3 (0.34) ALDH1A1KDM4EKMT2A
SCHEMBL11913425 0.83 SMN1; SMN2 (0.39) ALDH1A1MAPTSMN1; SMN2KDM4EKMT2A
SCHEMBL11903416 0.82 SMN1; SMN2 (0.32) ALDH1A1SMN1; SMN2
SCHEMBL1654720 0.80 KMO (0.41) ALDH1A1MAPTSMN1; SMN2KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 ALDH1A1 718/4885MAPT 4272/4885SMN1; SMN2 3709/4885

“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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