SCHEMBL20355708

SCHEMBL20355708

CC(C)(C)OC(=O)Cn1c(=O)oc2ccc(F)c(F)c21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.36
HDAC6 Q9UBN7 2/20 0.36
IDO1 P14902 4/20 0.36
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
KMT2A Q03164 1/20 0.35
CBX7 O95931 1/20 0.35
CDYL2 Q8N8U2 1/20 0.35
CDYL Q9Y232 1/20 0.35
CDY1; CDY1B Q9Y6F8 1/20 0.35
PLA2G7 Q13093 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL16186530 0.89 ALDH1A1 (0.39) ALDH1A1KDM4EL3MBTL1HDAC6IDO1
SCHEMBL16186524 0.88 ALDH1A1 (0.38) ALDH1A1KDM4EL3MBTL1HDAC6IDO1
SCHEMBL16186528 0.88 ALDH1A1 (0.40) ALDH1A1KDM4EL3MBTL1HDAC6IDO1
SCHEMBL20082384 0.86 KDM4E (0.42) ALDH1A1KDM4EL3MBTL1IDO1MEN1
SCHEMBL20355705 0.85 ALDH1A1 (0.42) ALDH1A1KDM4EIDO1CBX7CDYL2
SCHEMBL29670894 0.80 KMO (0.42) IDO1HPGD
SCHEMBL18329427 0.80 KMO (0.42) IDO1HPGD
SCHEMBL20356853 0.80 MEN1 (0.49) ALDH1A1L3MBTL1MEN1GAAPKM
SCHEMBL15157087 0.79 KMT2A (0.45) ALDH1A1KDM4EL3MBTL1IDO1MEN1
SCHEMBL16186523 0.75 IDO1 (0.62) ALDH1A1IDO1MEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10426784-B2 Imidazodiazepine compound ASTELLAS PHARMA INC. (JP) 2019-10-01 US disclosed
US-20180185383-A1 IMIDAZODIAZEPINE COMPOUND ASTELLAS PHARMA INC. (JP) 2018-07-05 US disclosed
US-20180185383-A1 IMIDAZODIAZEPINE COMPOUND ASTELLAS PHARMA INC. (JP) 2018-07-05 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 (2 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-20180185383-A1 IMIDAZODIAZEPINE COMPOUND HTR1D, DRD2, DRD1 ALDH1A1 1637/4885KDM4E 2920/4885L3MBTL1 3299/4885
US-10426784-B2 Imidazodiazepine compound GRIN2D, HTR1D, DRD2 ALDH1A1 1063/4885KDM4E 2841/4885L3MBTL1 3932/4885

“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.