SCHEMBL1610482

SCHEMBL1610482

COC(=O)c1nc(-c2ccc(C(F)(F)F)cc2)nc(NCc2ccco2)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.47
MAPT P10636 3/20 0.44
KMT2A Q03164 3/20 0.44
LMNA P02545 3/20 0.44
GAA P10253 2/20 0.44
MEN1 O00255 2/20 0.44
HTT P42858 2/20 0.44
CTNNB1 P35222 1/20 0.44
TCF7L2 Q9NQB0 1/20 0.44
NPSR1 Q6W5P4 4/20 0.43
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
F2 P00734 2/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 3/20 0.43
KDM4E B2RXH2 3/20 0.43
HSD17B10 Q99714 3/20 0.43
ALOX15 P16050 2/20 0.43
TSHR P16473 2/20 0.43
PDE5A O76074 1/20 0.43

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
SCHEMBL1609680 0.90 MAPT (0.47) PTGS2MAPTKMT2ALMNAGAA
SCHEMBL1610095 0.90 RAB9A (0.47) PTGS2MAPTKMT2ALMNAGAA
SCHEMBL120609 0.89 RAB9A (0.54) MAPTKMT2ALMNAMEN1HTT
SCHEMBL1609024 0.88 MAPT (0.57) MAPTKMT2ALMNAGAAMEN1
SCHEMBL1610594 0.87 MAPT (0.55) MAPTKMT2ALMNAGAAMEN1
SCHEMBL1609880 0.87 NOTUM (0.45) PTGS2MAPTKMT2ALMNAGAA
SCHEMBL1610042 0.87 HSD17B10 (0.44) PTGS2MAPTKMT2ALMNAGAA
SCHEMBL1611589 0.87 CTNNB1 (0.45) PTGS2MAPTKMT2ALMNAGAA
SCHEMBL1611051 0.87 HPGD (0.44) PTGS2MAPTKMT2ALMNAGAA
SCHEMBL1610840 0.87 CTNNB1 (0.45) PTGS2MAPTKMT2ALMNAGAA

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
WO-2009081112-A2 CHEMICAL COMPOUNDS SYNGENTA LIMITED (GB) 2009-07-02 WO 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 PTGS2 2717/4885MAPT 2800/4885KMT2A 2003/4885

“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.