SCHEMBL4173053

SCHEMBL4173053

Cn1nc(C(F)(F)F)c(CBr)c1OCCCF

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
CYP1A2 P05177 3/20 0.32
CYP2C9 P11712 3/20 0.32
CYP2C19 P33261 3/20 0.32
CYP3A4 P08684 1/20 0.31
L3MBTL1 Q9Y468 4/20 0.30
MAPT P10636 2/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
HTT P42858 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
SCHEMBL4216676 0.84 ALOX5AP (0.33) ALOX5APFEN1MEN1KMT2ASMN1; SMN2
SCHEMBL3753144 0.82 KMT2A (0.33) ALOX5APFEN1MEN1KMT2ASMN1; SMN2
SCHEMBL5374117 0.78 ALOX5AP (0.33) ALOX5APFEN1MEN1KMT2ACYP1A2
SCHEMBL4171199 0.76 MAPK1 (0.34) ALOX5APFEN1
SCHEMBL4170216 0.75 ALOX5AP (0.31) ALOX5APFEN1MEN1KMT2ACYP1A2
SCHEMBL1028460 0.75 ALOX5AP (0.32) ALOX5APFEN1MEN1KMT2ACYP1A2
SCHEMBL4167882 0.74 CYP1A2 (0.31) ALOX5APFEN1MEN1KMT2ASMN1; SMN2
SCHEMBL4174748 0.72 ALOX5AP (0.31) ALOX5APFEN1MEN1KMT2ACYP1A2
SCHEMBL938913 0.70 MPO (0.41) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C9
SCHEMBL4159027 0.70 SMN1; SMN2 (0.34) ALOX5APFEN1MEN1KMT2ASMN1; SMN2

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-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 ALOX5AP 4311/4885FEN1 2128/4885MEN1 1520/4885

“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.