SCHEMBL1609889

SCHEMBL1609889

COC(=O)c1nc(-c2ccc(Cl)c([N+](=O)[O-])c2)nc(N(C)c2ccco2)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.38
▸ LMNA P02545 3/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ RAF1 P04049 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ GFER P55789 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ HTT P42858 1/20 0.35
▸ PKM P14618 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
SCHEMBL1609926 0.92 MAPT (0.37) MAPTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL27856129 0.84 KDM4E (0.39) MAPTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL1609021 0.83 ALDH1A1 (0.42) MAPTLMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL1610593 0.82 TUBB4A (0.41) MAPTLMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL1609528 0.80 ALPL (0.37) MAPTLMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL1609769 0.80 CFTR (0.33) MAPTLMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL1610481 0.80 CFTR (0.38) SMN1; SMN2ALDH1A1HPGDHTT
SCHEMBL1610094 0.79 CHRNA7 (0.39) —
SCHEMBL1609888 0.78 MAPT (0.44) MAPTLMNAALDH1A1HPGDMAPK1
SCHEMBL11903207 0.77 HSD17B10 (0.36) MAPTLMNASMN1; SMN2ALDH1A1HPGD

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-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 — — 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-20110086759-A1 CHEMICAL COMPOUNDS DDT, PNPO, CBR3 MAPT 2800/4885LMNA 4805/4885SMN1; SMN2 2654/4885

“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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