SCHEMBL1609727

SCHEMBL1609727

COC(=O)c1nc(-c2ccc(C)c(C)c2)nc(NCc2ccco2)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.47
ALDH1A1 P00352 9/20 0.47
KDM4E B2RXH2 4/20 0.47
TDP1 Q9NUW8 2/20 0.47
GAA P10253 2/20 0.47
HPGD P15428 4/20 0.46
LMNA P02545 3/20 0.46
HTT P42858 3/20 0.46
TSHR P16473 3/20 0.46
TP53 P04637 2/20 0.46
MAPK1 P28482 2/20 0.46
HSD17B10 Q99714 2/20 0.46
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
SMN1; SMN2 Q16637 6/20 0.42
NPC1 O15118 5/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 1/20 0.42
RAB9A P51151 4/20 0.42
NPSR1 Q6W5P4 4/20 0.42

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
SCHEMBL1610506 0.93 MAPT (0.44) MAPTALDH1A1GAAHPGDLMNA
SCHEMBL1609852 0.93 MAPT (0.44) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL1610398 0.92 MAPT (0.43) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL12713367 0.92 MAPT (0.43) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL12713301 0.89 APP (0.43) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL1609927 0.89 MAPT (0.47) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL1609024 0.89 MAPT (0.57) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL1608896 0.89 APP (0.42) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL1609483 0.89 KDM4E (0.52) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL120609 0.88 RAB9A (0.54) MAPTALDH1A1KDM4ETDP1HPGD

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 3 patents. 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
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
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 2800/4885ALDH1A1 1562/4885KDM4E 2613/4885

“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.