SCHEMBL486208

SCHEMBL486208

COC(=O)C(=C1C(=O)N(c2ccccc2)N=C1C)C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.57
GAA P10253 5/20 0.57
MAPT P10636 5/20 0.57
MEN1 O00255 4/20 0.57
ALDH1A1 P00352 4/20 0.57
MAPK1 P28482 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
KAT8 Q9H7Z6 2/20 0.41
HSP90AA1 P07900 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
POLB P06746 2/20 0.40
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL486207 1.00 KMT2A (0.57) KMT2AGAAMAPTMEN1ALDH1A1
SCHEMBL486317 0.93 ALDH1A1 (0.49) KMT2AGAAMAPTMEN1ALDH1A1
SCHEMBL486319 0.93 ALDH1A1 (0.49) KMT2AGAAMAPTMEN1ALDH1A1
SCHEMBL486129 0.91 MAPT (0.45) KMT2AGAAMAPTMEN1ALDH1A1
SCHEMBL486130 0.91 MAPT (0.45) KMT2AGAAMAPTMEN1ALDH1A1
SCHEMBL486111 0.91 MEN1 (0.47) KMT2AGAAMAPTMEN1ALDH1A1
SCHEMBL486110 0.91 MEN1 (0.47) KMT2AGAAMAPTMEN1ALDH1A1
SCHEMBL486361 0.90 GAA (0.46) KMT2AGAAMAPTMEN1ALDH1A1
SCHEMBL486360 0.90 GAA (0.46) KMT2AGAAMAPTMEN1ALDH1A1
SCHEMBL486712 0.89 MAPT (0.43) KMT2AGAAMAPTMEN1ALDH1A1

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 KMT2A 776/4885GAA 3701/4885MAPT 2831/4885

“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.