SCHEMBL10316170

SCHEMBL10316170

CCO[C@@H]1[C@@H](OC)[C@H](C)O[C@H](OC(=O)Nc2ccc(-c3ncn(-c4ccc(OC(F)(F)C(F)(F)F)cc4)n3)cc2)[C@@H]1OC

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.33
CYP3A4 P08684 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.32
POLB P06746 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ESR2 Q92731 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ABL1 P00519 5/20 0.30
AURKA O14965 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL10316169 1.00 MAPT (0.33) MAPTCYP3A4ABCG2POLBMEN1
SCHEMBL18098917 0.96 MAPT (0.33) MAPTCYP3A4ABCG2POLBMEN1
SCHEMBL26266370 0.95 ABCG2 (0.32) MAPTCYP3A4ABCG2POLBABL1
SCHEMBL16078914 0.95 ABCG2 (0.32) MAPTCYP3A4ABCG2POLBABL1
SCHEMBL18098871 0.95 MAPT (0.35) MAPTCYP3A4ABCG2POLBMEN1
SCHEMBL18098901 0.94 MAPT (0.36) MAPTPOLBL3MBTL1ABL1LMNA
SCHEMBL16079290 0.94 MAPT (0.36) MAPTPOLBL3MBTL1ABL1LMNA
SCHEMBL18099074 0.94 ABCG2 (0.34) MAPTCYP3A4ABCG2ABL1
SCHEMBL29658131 0.94 ABCG2 (0.34) MAPTCYP3A4ABCG2ABL1
SCHEMBL18098874 0.94 ABCG2 (0.34) MAPTCYP3A4ABCG2ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2247603-B1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2016-09-28 EP disclosed
US-9018363-B2 Pesticidal compositions DOW AGROSCIENCES LLC (US) 2015-04-28 US disclosed
US-9018363-B2 Pesticidal compositions DOW AGROSCIENCES LLC (US) 2015-04-28 US disclosed
US-20120172218-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2012-07-05 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-20120172218-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PTMS MAPT 3378/4885CYP3A4 1477/4885ABCG2 3109/4885

“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.