SCHEMBL13044638

SCHEMBL13044638

CN1CCC(C(C(=O)O)c2ccc3c(c2)OCO3)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.47
MGLL Q99685 2/20 0.47
FAAH O00519 1/20 0.47
HPGD P15428 2/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MCL1 Q07820 1/20 0.46
MAPK9 P45984 1/20 0.45
ITGB3 P05106 1/20 0.45
ITGA2B P08514 1/20 0.45
MAPT P10636 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
ULK1 O75385 1/20 0.43

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 SCHEMBL3634574 0.99 TP53 (0.46) TP53MGLLFAAHHPGDPTGS1
SCHEMBL11161417 0.89 MAPK9 (0.51) MGLLFAAHHPGDPTGS1PTGS2
SCHEMBL3636820 0.79 TP53 (0.47) TP53HPGDKDM4EALDH1A1L3MBTL1
SCHEMBL3635007 0.77 TP53 (0.55) TP53KDM4EALDH1A1MAPTGAA
SCHEMBL2843826 0.76 OGA (0.42) TP53MGLLFAAHKDM4EL3MBTL1
SCHEMBL2843865 0.76 ACHE (0.51) MGLLFAAHHPGDKDM4EALDH1A1
SCHEMBL26698301 0.75 CHRM3 (0.61) KDM4EHTTKMT2A
SCHEMBL7975974 0.72 MAPK9 (0.49) MGLLFAAHHPGDPTGS1PTGS2
SCHEMBL9220209 0.72 PTGS1 (0.81) HPGDPTGS1PTGS2KDM4EALDH1A1
SCHEMBL805663 0.72 PTGS1 (0.81) HPGDPTGS1PTGS2KDM4EALDH1A1

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-20100286152-A1 N-PHENYL HYDRAZIDES AS MODULATORS OF THE GHRELIN RECEPTOR GLAXO GROUP LIMITED (GB) 2010-11-11 US disclosed
US-20100286152-A1 N-PHENYL HYDRAZIDES AS MODULATORS OF THE GHRELIN RECEPTOR GLAXO GROUP LIMITED (GB) 2010-11-11 US disclosed
WO-2008148853-A1 N-PHENYL HYDRAZIDES AS MODULATORS OF THE GHRELIN RECEPTOR GLAXO GROUP LIMITED (GB) 2008-12-11 WO 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-20100286152-A1 N-PHENYL HYDRAZIDES AS MODULATORS OF THE GHRELIN RECEPTOR GIPR, GHSR, GLP1R TP53 3879/4885MGLL 1932/4885FAAH 265/4885

“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.