SCHEMBL13626170

SCHEMBL13626170

CCNC(=O)C(NC(=O)CC)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.51
GPR88 Q9GZN0 1/20 0.51
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
CTSS P25774 2/20 0.47
CTSK P43235 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
CTSL P07711 1/20 0.46
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MTNR1A P48039 2/20 0.43
MTNR1B P49286 2/20 0.43
THRB P10828 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP3 P08254 1/20 0.42
MMP9 P14780 1/20 0.42
MMP14 P50281 1/20 0.42

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
SCHEMBL10076060 0.83 LMNA (0.53) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL13649434 0.83 LMNA (0.53) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL5743537 0.81 LMNA (0.51) LMNAPOLBMEN1KMT2AKDM4E
SCHEMBL21142858 0.81 LMNA (0.51) LMNAPOLBMEN1KMT2AKDM4E
SCHEMBL15443129 0.81 LMNA (0.51) LMNAPOLBMEN1KMT2AKDM4E
SCHEMBL16317174 0.81 LMNA (0.51) LMNAPOLBMEN1KMT2AKDM4E
SCHEMBL31621324 0.81 PKM (0.55) PKMGPR88POLBCTSSCTSK
SCHEMBL1361680 0.81 GPR88 (0.44) PKMGPR88LMNAPOLBCTSS
SCHEMBL6156046 0.81 GPR88 (0.44) PKMGPR88LMNAPOLBCTSS
SCHEMBL6225123 0.81 F2 (0.50) GPR88MEN1KMT2AALDH1A1

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-20090291998-A1 EPONEMYCIN AND EPOXOMICIN ANALOGS AND USES THEREOF EISAI R&D MANAGEMENT CO., LTD. 2009-11-26 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-20090291998-A1 EPONEMYCIN AND EPOXOMICIN ANALOGS AND USES THEREOF PSMC4, PSMB6, EPOR PKM 1951/4885GPR88 2865/4885LMNA 2465/4885

“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.