SCHEMBL4171920

SCHEMBL4171920

Cn1nc(C(F)(F)F)c(CS(=O)(=O)c2ncc(Br)s2)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
LMNA P02545 1/20 0.39
CYP2C19 P33261 6/20 0.38
CYP2C9 P11712 4/20 0.38
CYP3A4 P08684 4/20 0.38
CYP2D6 P10635 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
GAA P10253 1/20 0.38
CYP1A2 P05177 5/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
TDP1 Q9NUW8 1/20 0.30
POLB P06746 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
SCHEMBL4167245 0.84 ALDH1A1 (0.30) ALDH1A1LMNA
SCHEMBL4166340 0.78 MEN1 (0.32) ALDH1A1LMNACYP2C19CYP2C9CYP3A4
SCHEMBL4164880 0.77 MEN1 (0.32) ALDH1A1LMNACYP2C19CYP2C9CYP3A4
SCHEMBL4167434 0.76 MEN1 (0.31) ALDH1A1LMNACYP2C19CYP2D6CYP1A2
SCHEMBL13926128 0.76 MEN1 (0.31) ALDH1A1LMNACYP2C19CYP2D6CYP1A2
SCHEMBL4169663 0.76 MEN1 (0.38) ALDH1A1LMNACYP2C19CYP2C9CYP3A4
SCHEMBL2892161 0.74 CYP2C9 (0.35) ALDH1A1LMNACYP2C19CYP2C9CYP3A4
SCHEMBL2885500 0.74 ALDH1A1 (0.36) ALDH1A1LMNACYP2C19CYP2C9CYP3A4
SCHEMBL2892736 0.74 ALDH1A1 (0.36) ALDH1A1LMNACYP2C19CYP2C9CYP3A4
SCHEMBL2885498 0.74 ALDH1A1 (0.36) ALDH1A1LMNACYP2C19CYP2C9CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090048112-A1 Novel Herbicides SYNGENTA LIMITED (GB) 2009-02-19 US disclosed
US-20090048112-A1 Novel Herbicides SYNGENTA LIMITED (GB) 2009-02-19 US disclosed
US-20090048112-A1 Novel Herbicides SYNGENTA LIMITED (GB) 2009-02-19 US disclosed
EP-1885720-A2 4-(THIAZOL-2-YLTHIOALKYL)-PYRAZOLES AND THEIR USE AS HERBICIDES Syngenta Limited (GB) 2008-02-13 EP disclosed
WO-2006123088-A2 4- (THIAZOL-2-YLTHIOALKYL) -PYRAZOLES AND THEIR USE AS HERBICIDES SYNGENTA LIMITED (GB) 2006-11-23 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-20090048112-A1 Novel Herbicides HAX1, MTX1, CYP4X1 ALDH1A1 312/4885LMNA 2455/4885CYP2C19 204/4885

“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.