SCHEMBL6249727

SCHEMBL6249727

O=C(Nc1nc(C(F)(F)C(F)(F)F)c(CO)s1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JUN P05412 2/20 0.41
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
PI4KB Q9UBF8 1/20 0.40
RAF1 P04049 1/20 0.40
BRAF P15056 1/20 0.40
KCNH2 Q12809 1/20 0.40
HDAC3 O15379 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
P2RX1 P51575 2/20 0.38
GAA P10253 1/20 0.36
DHODH Q02127 1/20 0.36
MAPT P10636 1/20 0.36
RHOC P08134 1/20 0.36
RHOA P61586 1/20 0.36

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
SCHEMBL6247042 0.91 JUN (0.41) JUNNFKB1NFKB2RELAPI4KB
SCHEMBL6250718 0.89 JUN (0.42) JUNNFKB1NFKB2RELAPI4KB
SCHEMBL6247803 0.83 JUN (0.42) JUNNFKB1NFKB2RELAPI4KB
SCHEMBL6249568 0.82 PI4KB (0.45) JUNNFKB1NFKB2RELAPI4KB
SCHEMBL6365689 0.81 JUN (0.43) JUNNFKB1NFKB2RELAPI4KB
SCHEMBL6245874 0.80 SMN1; SMN2 (0.49) NFKB1LMNATP53DHODH
SCHEMBL6683045 0.76 PI4KB (0.45) JUNNFKB1NFKB2RELAPI4KB
SCHEMBL6245913 0.72 KCNQ3 (0.56) LMNAP2RX1DHODHMAPT
SCHEMBL27935938 0.72 MAPT (0.46) RAF1BRAFKCNH2LMNAMAPT
SCHEMBL7230088 0.69 POLB (0.34) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005041665-A1 INSECTICIDAL PERFLUOROALKYLTHIAZOLE DERIVATIVES NIPPON SODA CO. LTD. (JP) 2005-05-12 WO disclosed
US-20050090506-A1 Insecticidal perfluoroalkylthiazole derivatives NIPPON SODA CO., LTD. 2005-04-28 US 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-20050090506-A1 Insecticidal perfluoroalkylthiazole derivatives FFAR3, CYP4F3, NPFFR1 JUN 3855/4885NFKB1 3016/4885NFKB2 4334/4885

“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.