SCHEMBL14770515

SCHEMBL14770515

Cc1ccc(COc2ccc(C(O)c3nc4cc(I)cnc4[nH]3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MLKL Q8NB16 1/20 0.42
APP P05067 7/20 0.40
ALOX5 P09917 2/20 0.40
FFAR1 O14842 2/20 0.38
MAOB P27338 2/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 2/20 0.37
ALDH1A1 P00352 1/20 0.37
PARP10 Q53GL7 1/20 0.36
NPC1 O15118 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 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
SCHEMBL12065636 0.88 MLKL (0.42) MLKLALOX5FFAR1MAOBMAPT
SCHEMBL14770522 0.76 NPC1 (0.37) APPALOX5FFAR1MAOBMAPT
SCHEMBL14770523 0.76 FFAR1 (0.36) APPFFAR1MAOBMAPTMAPK1
SCHEMBL12065313 0.73 FFAR1 (0.42) MLKLALOX5FFAR1MAOBMAPT
SCHEMBL14770521 0.70 NPC1 (0.42) MLKLFFAR1MAOBMAPTMAPK1
SCHEMBL14770525 0.69 APP (0.42) APPFFAR1MAOB
SCHEMBL12066068 0.69 MAOB (0.40) APPFFAR1MAOBMAPTNPC1
SCHEMBL14770724 0.69 MEN1 (0.41) MLKLMAPK1ALDH1A1
SCHEMBL14770511 0.69 MEN1 (0.44) MLKLMAPTMAPK1ALDH1A1
SCHEMBL14770725 0.69 MEN1 (0.39) MLKLMAPTMAPK1ALDH1A1NPC1

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 2378/4885APP 2799/4885ALOX5 3826/4885

“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.