SCHEMBL13664662

SCHEMBL13664662

O=C1c2ccccc2-c2ccc(N=C=S)cc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.51
MIF P14174 1/20 0.45
USP8 P40818 1/20 0.44
USP7 Q93009 1/20 0.44
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
ALDH1A1 P00352 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
MAPK1 P28482 3/20 0.44
CYP3A4 P08684 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
ELANE P08246 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
PTPRC P08575 3/20 0.43
MEN1 O00255 3/20 0.43
S100A4 P26447 3/20 0.43
KMT2A Q03164 3/20 0.43
LMNA P02545 3/20 0.43
PLA2G1B P04054 3/20 0.43

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
SCHEMBL15432851 0.98 CYP2C19 (0.49) CYP2C19MIFUSP8USP7NPC1
SCHEMBL11351193 0.81 CYP2C19 (0.50) CYP2C19USP8USP7NPC1RAB9A
SCHEMBL13668026 0.79 CYP2C19 (0.56) CYP2C19USP8USP7NPC1RAB9A
SCHEMBL13179763 0.77 CYP2C19 (0.57) CYP2C19USP8USP7NPC1RAB9A
SCHEMBL9064366 0.76 MIF (0.42) MIFALDH1A1CYP3A4TDP1TP53
SCHEMBL10617594 0.76 CYP2C19 (0.51) CYP2C19USP8USP7NPC1RAB9A
SCHEMBL10617590 0.76 CYP2C19 (0.51) CYP2C19USP8USP7NPC1RAB9A
SCHEMBL542807 0.75 MAPK1 (0.50) CYP2C19USP8USP7NPC1RAB9A
SCHEMBL21084970 0.75 CYP2C19 (0.54) CYP2C19USP8USP7NPC1RAB9A
SCHEMBL940920 0.75 MAPK1 (0.50) CYP2C19USP8USP7NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270372-A1 NOVEL DERIVATIVES OF BENZIMIDAZOLE AND IMIDAZO-PYRIDINE AND THEIR USE AS MEDICAMENTS SOCIETE DE CONSEILS DE RECHERCHES ET (FR) 2009-10-29 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-20090270372-A1 NOVEL DERIVATIVES OF BENZIMIDAZOLE AND IMIDAZO-PYRIDINE AND THEIR USE AS MEDICAMENTS MC4R, MC3R, MC1R CYP2C19 801/4885MIF 277/4885USP8 3995/4885

“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.