SCHEMBL13779396

SCHEMBL13779396

COC(=O)[C@H](Cc1ccc(OC(C)=O)c(OC(C)=O)c1)NC(=O)C1(N)CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.46
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALOX15 P16050 3/20 0.41
LNPEP Q9UIQ6 1/20 0.41
NLRP3 Q96P20 2/20 0.41
CTSC P53634 1/20 0.40
KCNH2 Q12809 1/20 0.40
CCR5 P51681 1/20 0.39
PTGS1 P23219 1/20 0.39
MMP1 P03956 1/20 0.39
INSR P06213 1/20 0.39
IGF1R P08069 1/20 0.39
MDM4 O15151 1/20 0.39
MDM2 Q00987 1/20 0.39
ATM Q13315 1/20 0.39

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
Hydrochloric Acid SCHEMBL4174922 0.99 LCK (0.45) LCKKMT2ANPSR1ALOX15LNPEP
SCHEMBL13779400 0.99 LCK (0.46) LCKKMT2ANPSR1ALOX15LNPEP
Hydrochloric Acid SCHEMBL4194468 0.98 LCK (0.46) LCKKMT2ANPSR1ALOX15LNPEP
SCHEMBL13779403 0.97 KMT2A (0.47) LCKKMT2ANPSR1ALOX15LNPEP
Hydrochloric Acid SCHEMBL4180569 0.96 KMT2A (0.47) LCKKMT2ANPSR1ALOX15LNPEP
Hydrochloric Acid SCHEMBL4189553 0.88 LCK (0.41) LCKKMT2ANPSR1ALOX15LNPEP
SCHEMBL13779407 0.86 LCK (0.43) LCKKMT2ANPSR1ALOX15NLRP3
Hydrochloric Acid SCHEMBL4173302 0.85 LCK (0.43) LCKKMT2ANPSR1ALOX15NLRP3
Hydrochloric Acid SCHEMBL4173305 0.85 LCK (0.43) LCKKMT2ANPSR1ALOX15NLRP3
SCHEMBL13779393 0.84 LCK (0.65) LCKKMT2ANPSR1ALOX15LNPEP

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-20090170937-A1 Amino Acid Derivatives PROXIMAGEN LTD. (GB) 2009-07-02 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-20090170937-A1 Amino Acid Derivatives PARK7, PRMT7, ADCY7 LCK 2992/4885KMT2A 1219/4885NPSR1 296/4885

“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.