SCHEMBL22925922

SCHEMBL22925922

N/C(=N/O)c1cnc(Nc2ncc(-c3ccc(OC(F)(F)F)cc3)o2)cn1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.36
CYP1A2 P05177 1/20 0.35
ABL1 P00519 1/20 0.34
BCR P11274 1/20 0.34
TRPV1 Q8NER1 4/20 0.34
VCP P55072 2/20 0.34
ALOX5 P09917 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
FLT1 P17948 2/20 0.33
FLT4 P35916 2/20 0.33
TP53 P04637 1/20 0.33
TEK Q02763 1/20 0.32
KCNH2 Q12809 2/20 0.32
SCN5A Q14524 1/20 0.32
SCN9A Q15858 1/20 0.32
SCN10A Q9Y5Y9 1/20 0.32

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
SCHEMBL28733793 1.00 KDR (0.36) KDRCYP1A2ABL1BCRTRPV1
SCHEMBL29620994 0.88 KDR (0.37) KDRCYP1A2ABL1BCRTRPV1
SCHEMBL22925595 0.86 TRPV1 (0.46) KDRTRPV1VCPALOX5FLT1
SCHEMBL28733706 0.86 TRPV1 (0.46) KDRTRPV1VCPALOX5FLT1
SCHEMBL24636896 0.86 VCP (0.41) KDRABL1BCRVCPALOX5
SCHEMBL29696270 0.86 VCP (0.41) KDRABL1BCRVCPALOX5
SCHEMBL22925695 0.83 VCP (0.51) KDRTRPV1VCPALOX5FLT1
SCHEMBL29696286 0.83 VCP (0.51) KDRTRPV1VCPALOX5FLT1
SCHEMBL28733821 0.83 VCP (0.51) KDRTRPV1VCPALOX5FLT1
SCHEMBL28733789 0.82 KDR (0.36) KDRCYP1A2TRPV1VCPALOX5

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-20220274970-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2022-09-01 US disclosed
WO-2021012018-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2021-01-28 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-20220274970-A1 INHIBITOR COMPOUNDS SERPINB1, MMP1, SSB KDR 3951/4885CYP1A2 3598/4885ABL1 1897/4885

“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.