SCHEMBL2928941

SCHEMBL2928941

O=S(=O)(O)Cc1cc(C(F)(F)F)ccc1Br

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.39
ACP1 P24666 3/20 0.38
MMP1 P03956 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
MMP8 P22894 1/20 0.38
MMP13 P45452 1/20 0.38
CYP19A1 P11511 1/20 0.38
TAS2R14 Q9NYV8 1/20 0.38
AVPR2 P30518 1/20 0.36
GPR27 Q9NS67 1/20 0.36
MAPT P10636 1/20 0.36
XBP1 P17861 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CES2 O00748 3/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
KIF11 P52732 1/20 0.36
PTPN1 P18031 2/20 0.35

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
SCHEMBL271228 0.83 KIF11 (0.39) ACLYMMP1CA1CA2MMP2
SCHEMBL271970 0.83 CYP19A1 (0.38) ACLYMMP1CA1CA2CYP19A1
SCHEMBL30214792 0.83 KIF11 (0.50) ACLYCA1CA2MAPTKIF11
SCHEMBL2906179 0.81 CES2 (0.47) ACP1MMP1CA1CA2MMP2
SCHEMBL276976 0.80 MCL1 (0.46) MAPTMRGPRX4
SCHEMBL1601756 0.80 MMP1 (0.38) ACLYACP1MMP1CA1CA2
SCHEMBL271995 0.79 MCL1 (0.44) MAPTMRGPRX4
SCHEMBL15067318 0.78 ACP1 (0.38) ACP1MMP1CA1CA2MMP2
SCHEMBL4680952 0.77 IDO1 (0.40) TAS2R14MAPTXBP1NPSR1CES2
SCHEMBL142651 0.77 KLF10 (0.40) TAS2R14MAPTXBP1NPSR1CES2

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-2220056-B1 HERBICIDAL COMPOUNDS SYNGENTA LTD (GB) 2015-09-30 EP disclosed
US-20100323889-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-12-23 US disclosed
EP-2220056-A1 HERBICIDAL COMPOUNDS Syngenta Limited (GB) 2010-08-25 EP disclosed
WO-2009063180-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2009-05-22 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-20100323889-A1 HERBICIDAL COMPOUNDS CBR3, DDT, CBR1 ACLY 621/4885ACP1 3701/4885MMP1 1849/4885

“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.