SCHEMBL486538

SCHEMBL486538

COC(=O)/C(=C1/C(=O)N(c2ccc(OC(C)C)cc2)N=C1C)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.39
MAPT P10636 5/20 0.39
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 2/20 0.39
GAA P10253 1/20 0.39
TP53 P04637 2/20 0.37
NLRP1 Q9C000 1/20 0.36
USP2 O75604 1/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HPGD P15428 1/20 0.35
ACACB O00763 1/20 0.35
GLA P06280 1/20 0.35
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KAT8 Q9H7Z6 1/20 0.35
DGAT1 O75907 1/20 0.35
ACSS2 Q9NR19 1/20 0.35
LMNA P02545 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
SCHEMBL486539 1.00 KMT2A (0.39) KMT2AMAPTALDH1A1MEN1GAA
SCHEMBL486092 0.89 MEN1 (0.42) KMT2AMAPTALDH1A1MEN1GAA
SCHEMBL486429 0.87 MEN1 (0.40) KMT2AMAPTALDH1A1MEN1GAA
SCHEMBL486711 0.85 MAPT (0.43) KMT2AMAPTALDH1A1MEN1GAA
SCHEMBL486110 0.85 MEN1 (0.47) KMT2AMAPTALDH1A1MEN1GAA
SCHEMBL486345 0.84 MAPT (0.42) KMT2AMAPTALDH1A1MEN1GAA
SCHEMBL486776 0.84 AMY1A (0.43) KMT2AMAPTALDH1A1MEN1GAA
SCHEMBL486344 0.84 MAPT (0.42) KMT2AMAPTALDH1A1MEN1GAA
SCHEMBL486208 0.84 KMT2A (0.57) KMT2AMAPTALDH1A1MEN1GAA
SCHEMBL486300 0.83 MAPT (0.41) KMT2AMAPTALDH1A1MEN1GAA

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 776/4885MAPT 2831/4885ALDH1A1 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.