SCHEMBL353368

SCHEMBL353368

Cn1ncc(C(N)=O)c1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MET P08581 1/20 0.40
AXL P30530 1/20 0.40
KDM4E B2RXH2 5/20 0.39
ALDH1A1 P00352 4/20 0.39
CYP11B2 P19099 1/20 0.39
AR P10275 1/20 0.39
SSTR2 P30874 1/20 0.38
KCNH2 Q12809 1/20 0.38
HPGD P15428 2/20 0.38
MAPK1 P28482 2/20 0.38
HSD17B10 Q99714 2/20 0.38
HTR1A P08908 1/20 0.38
HTR1D P28221 1/20 0.38
HTR1B P28222 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
MGLL Q99685 1/20 0.36
RIPK2 O43353 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
SCHEMBL26422018 0.88 AR (0.35) POLBMAPTSMN1; SMN2METAXL
SCHEMBL1196081 0.84 POLB (0.57) POLBMAPTSMN1; SMN2METAXL
SCHEMBL939312 0.82 MAPT (0.41) POLBMAPTSMN1; SMN2METAXL
SCHEMBL2322890 0.79 MET (0.43) POLBMAPTSMN1; SMN2METAXL
SCHEMBL20683253 0.79 KEAP1 (0.43) POLBMAPTSMN1; SMN2METAXL
SCHEMBL353360 0.79 MET (0.46) POLBMAPTSMN1; SMN2METAXL
SCHEMBL1406639 0.79 TRPA1 (0.42) POLBMAPTSMN1; SMN2METKDM4E
SCHEMBL5204576 0.79 TSHR (0.44) POLBMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL27758481 0.77 CNR2 (0.37) POLBMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL15354814 0.76 TRPC3 (0.50) POLBMAPTSMN1; SMN2METAXL

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
US-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US disclosed
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 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-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds NAAA, AADAC, RPSA POLB 1884/4885MAPT 2275/4885SMN1; SMN2 2356/4885

“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.