SCHEMBL16710550

SCHEMBL16710550

COCc1cccc(OCc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.65
NR4A2 P43354 2/20 0.63
MRGPRX4 Q96LA9 1/20 0.59
MAPT P10636 2/20 0.59
HTT P42858 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
POLB P06746 1/20 0.56
IDO1 P14902 2/20 0.55
MAOA P21397 1/20 0.55
FFAR1 O14842 1/20 0.53
FFAR4 Q5NUL3 1/20 0.53

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
SCHEMBL171782 0.89 IDO1 (0.68) MAOBNR4A2MAPTHTTL3MBTL1
SCHEMBL16710559 0.88 MAOB (0.52) MAOBNR4A2MRGPRX4MAPTHTT
SCHEMBL16710623 0.88 MAOB (0.55) MAOBNR4A2MRGPRX4MAPTHTT
SCHEMBL13970685 0.86 IDO1 (0.53) MAOBNR4A2MRGPRX4MAPTHTT
SCHEMBL12879351 0.85 MAOB (0.65) MAOBNR4A2MRGPRX4MAPTHTT
SCHEMBL18161369 0.85 MAOB (0.65) MAOBNR4A2MRGPRX4MAPTHTT
SCHEMBL5669711 0.84 MAOB (0.74) MAOBNR4A2MRGPRX4MAPTHTT
SCHEMBL4700356 0.83 NR4A2 (0.68) MAOBNR4A2MRGPRX4MAPTHTT
SCHEMBL31172140 0.82 MAOB (0.76) MAOBNR4A2MRGPRX4MAPTHTT
SCHEMBL18164545 0.82 MAOB (0.63) MAOBNR4A2MRGPRX4MAPTHTT

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-20150133446-A1 IMIDAZOTHIADIAZOLE DERIVATIVES AS PROTEASE ACTIVATED RECEPTOR 4 (PAR4) INHIBITORS FOR TREATING PLATELET AGGREGATION UNIVERSITE DE MONTREAL (CA) 2015-05-14 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-20150133446-A1 IMIDAZOTHIADIAZOLE DERIVATIVES AS PROTEASE ACTIVATED RECEPTOR 4 (PAR4) INHIBITORS FOR TREATING PLATELET AGGREGATION F2RL3, F2R, F2RL1 MAOB 2077/4885NR4A2 733/4885MRGPRX4 14/4885

“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.