SCHEMBL15898542

SCHEMBL15898542

COC(=O)c1ccc(C(=O)OC)c(NC(=O)C(C)N)c1

nearest known ligand 0.78

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 18/20 0.78
ALDH1A1 P00352 15/20 0.78
LMNA P02545 2/20 0.71
KMT2A Q03164 2/20 0.68
HPGD P15428 5/20 0.57
HSD17B10 Q99714 4/20 0.57
ATM Q13315 3/20 0.57
GAA P10253 5/20 0.56
GLA P06280 3/20 0.56
MAPT P10636 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
CASP1 P29466 1/20 0.54
CASP7 P55210 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.53
MEN1 O00255 1/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
ERAP2 Q6P179 1/20 0.50
LNPEP Q9UIQ6 1/20 0.50

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
SCHEMBL15894478 0.86 KDM4E (0.58) KDM4EALDH1A1LMNAKMT2AHPGD
SCHEMBL7926073 0.85 KDM4E (0.57) KDM4EALDH1A1LMNAKMT2AHPGD
Hydrochloric Acid SCHEMBL1391475 0.84 KDM4E (0.56) KDM4EALDH1A1LMNAKMT2AHPGD
SCHEMBL16709745 0.84 KDM4E (0.56) KDM4EALDH1A1LMNAKMT2AMAPT
Hydrochloric Acid SCHEMBL1391474 0.84 KDM4E (0.56) KDM4EALDH1A1LMNAKMT2AHPGD
SCHEMBL27203069 0.82 KDM4E (0.74) KDM4EALDH1A1LMNAKMT2AHPGD
SCHEMBL7925290 0.82 XDH (0.54) KDM4EALDH1A1LMNAKMT2AHPGD
SCHEMBL558695 0.81 KDM4E (0.68) KDM4EALDH1A1LMNAKMT2AHPGD
Hydrochloric Acid SCHEMBL1391619 0.81 XDH (0.53) KDM4EALDH1A1LMNAKMT2AHPGD
Hydrochloric Acid SCHEMBL1391618 0.81 XDH (0.53) KDM4EALDH1A1LMNAKMT2AHPGD

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-20140205846-A1 MULTI-DIMENSIONAL NETWORKS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-07-24 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-20140205846-A1 MULTI-DIMENSIONAL NETWORKS DCX, CCNB2, CCNA2 KDM4E 3930/4885ALDH1A1 1594/4885LMNA 3350/4885

“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.