SCHEMBL6740540

SCHEMBL6740540

COc1cc(-c2nsc(C(F)(F)F)c2Cl)c(F)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 4/20 0.36
HSP90AB1 P08238 4/20 0.36
FFAR4 Q5NUL3 6/20 0.33
FFAR1 O14842 1/20 0.33
PDE7A Q13946 2/20 0.32
PPOX P50336 1/20 0.32
GAA P10253 1/20 0.31
NPC1 O15118 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
PMM2 O15305 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
G6PD P11413 1/20 0.31
HPGD P15428 1/20 0.31
ALOX12 P18054 1/20 0.31
HK1 P19367 1/20 0.31
MPI P34949 1/20 0.31
KMT2A Q03164 1/20 0.31
HKDC1 Q2TB90 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
SCHEMBL6742932 0.81 FFAR4 (0.36) FFAR4FFAR1PPOXGAAKDM4E
SCHEMBL6738642 0.81 PGK1 (0.36) FFAR4FFAR1
SCHEMBL6741811 0.81 FFAR4 (0.41) FFAR4FFAR1KDM4EALDH1A1HPGD
SCHEMBL6734563 0.80 FFAR4 (0.35) FFAR4FFAR1
SCHEMBL6738558 0.77 STING1 (0.37) PPOXNPC1KDM4EALDH1A1MAPT
SCHEMBL6741291 0.76 MAPT (0.37) HSP90AA1HSP90AB1GAANPC1KDM4E
SCHEMBL6983694 0.74 MAPT (0.38) PPOXNPC1KDM4EMEN1ALDH1A1
SCHEMBL5398257 0.74 CYP1A2 (0.35) HSP90AA1HSP90AB1PPOXNPC1MEN1
SCHEMBL6716002 0.74 EGFR (0.37) HSP90AA1HSP90AB1PPOX
SCHEMBL6719990 0.72 EGFR (0.39) HSP90AA1HSP90AB1PPOXGAANPC1

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-20040023807-A1 3-Arylisothiazoles and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2004-02-05 US disclosed
EP-1289970-A1 3-ARYLISOTHIAZOLES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2003-03-12 EP disclosed
WO-2001087863-A1 3-ARYLISOTHIAZOLES AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2001-11-22 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-20040023807-A1 3-Arylisothiazoles and their use as herbicides DDT, HAX1, SULT1E1 HSP90AA1 1442/4885HSP90AB1 1392/4885FFAR4 3522/4885

“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.