SCHEMBL14770697

SCHEMBL14770697

COc1ccc(C(O)c2nc3cc(Cl)ccc3[nH]2)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MLKL Q8NB16 2/20 0.51
GAA P10253 2/20 0.44
MTNR1B P49286 3/20 0.43
MTNR1A P48039 2/20 0.43
FLT3 P36888 2/20 0.42
CHEK2 O96017 1/20 0.42
CYP1A2 P05177 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PDGFRB P09619 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
AMY1A P0DUB6 1/20 0.39
MAP2 P11137 1/20 0.39
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL14770690 0.89 MLKL (0.52) MLKLGAAMTNR1BMTNR1ACHEK2
SCHEMBL12066577 0.86 MLKL (0.59) MLKLGAAFLT3CHEK2CYP1A2
SCHEMBL14770550 0.86 FLT3 (0.40) MLKLGAAFLT3CYP1A2MEN1
SCHEMBL14770701 0.86 MLKL (0.49) MLKLGAAMTNR1BMTNR1AFLT3
SCHEMBL14770470 0.85 MLKL (0.48) MLKLGAAMTNR1BMTNR1AFLT3
SCHEMBL14770608 0.85 MLKL (0.48) MLKLGAAMTNR1BMTNR1AFLT3
SCHEMBL12066599 0.84 MLKL (0.45) MLKLGAACYP1A2
SCHEMBL14770511 0.82 MEN1 (0.44) MLKLGAAMTNR1BMTNR1ACHEK2
SCHEMBL14770699 0.82 MLKL (0.46) MLKLGAAMTNR1BMTNR1ACHEK2
SCHEMBL14770471 0.82 MEN1 (0.55) MLKLGAAMTNR1BMTNR1ACHEK2

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-9096531-B2 Fused imidazole derivative TOA EIYO LTD. (JP) 2015-08-04 US disclosed
US-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE TOA EIYO LTD. (JP) 2013-03-14 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-20130065896-A1 FUSED IMIDAZOLE DERIVATIVE CACNA1E, CACNA1G, CACNA1A MLKL 2378/4885GAA 3586/4885MTNR1B 252/4885

“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.