SCHEMBL13044526

SCHEMBL13044526

CN1CCN(C(C(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccc3c(c2)OCO3)CC1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 2/20 0.61
GAA P10253 3/20 0.52
HTT P42858 3/20 0.52
USP2 O75604 2/20 0.52
NPSR1 Q6W5P4 4/20 0.48
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 1/20 0.47
TP53 P04637 3/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 3/20 0.46
TSHR P16473 2/20 0.45
KMT2A Q03164 1/20 0.45
POLB P06746 1/20 0.44
TACR1 P25103 1/20 0.43
UBE2M P61081 1/20 0.43
DCUN1D1 Q96GG9 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 SCHEMBL3638707 0.99 GHSR (0.60) GHSRGAAHTTUSP2NPSR1
SCHEMBL3636800 0.94 GHSR (0.61) GHSRGAAHTTUSP2NPSR1
SCHEMBL3635412 0.88 GHSR (0.58) GHSRGAAHTTUSP2NPSR1
SCHEMBL3743236 0.85 GAA (0.55) GHSRGAAHTTUSP2NPSR1
Hydrochloric Acid SCHEMBL3637123 0.84 GAA (0.54) GHSRGAAHTTUSP2NPSR1
SCHEMBL13044525 0.83 GHSR (0.68) GHSRALDH1A1KDM4EMAPTKMT2A
SCHEMBL3634225 0.83 GHSR (0.67) GHSRGAAHTTNPSR1ALDH1A1
SCHEMBL3638183 0.81 GHSR (0.71) GHSRHTTALDH1A1KDM4ETP53
SCHEMBL13078473 0.81 GHSR (0.51) GHSRGAAHTTUSP2ALDH1A1
SCHEMBL3634157 0.80 GHSR (0.61) GHSRTACR1

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 GHSR 2/4885GAA 806/4885HTT 316/4885

“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.