SCHEMBL4459100

SCHEMBL4459100

O=C1NCCC(C(=O)O)NC1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAD P27708 2/20 0.39
CYP2D6 P10635 2/20 0.37
LMNA P02545 2/20 0.37
BLM P54132 2/20 0.37
TSHR P16473 2/20 0.37
PMP22 Q01453 2/20 0.37
ALOX15 P16050 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 1/20 0.37
THRB P10828 1/20 0.37
KMT2A Q03164 1/20 0.37
HTT P42858 1/20 0.35
MME P08473 5/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33

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
SCHEMBL29953785 0.83 CAD (0.47) CADCYP2D6LMNABLMTSHR
SCHEMBL13439697 0.83 CAD (0.47) CADCYP2D6LMNABLMTSHR
SCHEMBL3548899 0.83 CAD (0.47) CADCYP2D6LMNABLMTSHR
Pidolic Acid SCHEMBL9621930 0.80 CAD (0.39) CADCYP2D6LMNABLMTSHR
SCHEMBL829988 0.77 CYP2D6 (0.40) CADCYP2D6LMNABLMTSHR
SCHEMBL15057980 0.77 CYP2D6 (0.36) CADCYP2D6LMNABLMTSHR
SCHEMBL5807407 0.74 CYP2D6 (0.37) CADCYP2D6LMNABLMTSHR
Proline SCHEMBL4596023 0.74 MEN1 (0.41) BLMMEN1KMT2A
Proline SCHEMBL4596015 0.74 MEN1 (0.41) BLMMEN1KMT2A
SCHEMBL5852589 0.71 CAD (0.41) CADCYP2D6LMNABLMTSHR

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-20090298781-A1 COMPOUNDS FOR THE INHIBITION OF APOPTOSIS CONSEJO SUPERIOR DE (ES) 2009-12-03 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-20090298781-A1 COMPOUNDS FOR THE INHIBITION OF APOPTOSIS BAX, BCL2, CASP3 CAD 1657/4885CYP2D6 1569/4885LMNA 120/4885

“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.