SCHEMBL486345

SCHEMBL486345

COC(=O)C(=C1C(=O)N(c2ccc(C(F)(F)F)cc2)N=C1C)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
SIRT5 Q9NXA8 2/20 0.39
DHODH Q02127 1/20 0.38
KAT8 Q9H7Z6 2/20 0.37
ATM Q13315 1/20 0.36
GRM5 P41594 1/20 0.36
EP300 Q09472 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NPBWR1 P48145 1/20 0.35
MCHR1 Q99705 1/20 0.35
MALT1 Q9UDY8 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL486344 1.00 MAPT (0.42) MAPTMEN1ALDH1A1GAAKMT2A
SCHEMBL486299 0.92 MAPT (0.41) MAPTMEN1ALDH1A1GAAKMT2A
SCHEMBL486300 0.92 MAPT (0.41) MAPTMEN1ALDH1A1GAAKMT2A
SCHEMBL486129 0.91 MAPT (0.45) MAPTMEN1ALDH1A1GAAKMT2A
SCHEMBL486130 0.91 MAPT (0.45) MAPTMEN1ALDH1A1GAAKMT2A
SCHEMBL486712 0.89 MAPT (0.43) MAPTMEN1ALDH1A1GAAKMT2A
SCHEMBL486711 0.89 MAPT (0.43) MAPTMEN1ALDH1A1GAAKMT2A
SCHEMBL486091 0.88 MEN1 (0.42) MAPTMEN1ALDH1A1GAAKMT2A
SCHEMBL486776 0.88 AMY1A (0.43) MAPTMEN1ALDH1A1GAAKMT2A
SCHEMBL486775 0.88 AMY1A (0.43) MAPTMEN1ALDH1A1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2145884-B1 INDOLEDIONE DERIVATIVE MSD KK (JP) 2014-08-06 EP disclosed
US-8106086-B2 Indoledione derivative MSD K.K. (JP) 2012-01-31 US disclosed
US-20100056597-A1 INDOLEDIONE DERIVATIVE MSD K.K. (JP) 2010-03-04 US disclosed
EP-2145884-A1 INDOLEDIONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-01-20 EP 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-20100056597-A1 INDOLEDIONE DERIVATIVE LIPE, IDO1, ADRA1A MAPT 2831/4885MEN1 2086/4885ALDH1A1 303/4885

“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.