SCHEMBL13044840

SCHEMBL13044840

O=C(O)C(c1ccccc1OC(F)(F)F)N1CCN2CCC[C@@H]2C1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
GHSR Q92847 1/20 0.41
TACR1 P25103 5/20 0.40
MGLL Q99685 1/20 0.39
CCR3 P51677 2/20 0.38
HRH3 Q9Y5N1 2/20 0.38
SLC6A4 P31645 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
SLC6A1 P30531 3/20 0.37
CHRM1 P11229 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
WNT3A P56704 1/20 0.36

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 SCHEMBL3737450 0.99 TSHR (0.42) TSHRGHSRTACR1MGLLCCR3
Hydrochloric Acid SCHEMBL3737455 0.99 TSHR (0.42) TSHRGHSRTACR1MGLLCCR3
SCHEMBL13044848 0.87 TSHR (0.55) TSHRTACR1CCR3ALDH1A1MEN1
Hydrochloric Acid SCHEMBL3738086 0.86 TSHR (0.54) TSHRTACR1CCR3ALDH1A1MEN1
Hydrochloric Acid SCHEMBL3635175 0.86 TSHR (0.54) TSHRTACR1CCR3ALDH1A1MEN1
SCHEMBL3741684 0.84 TSHR (0.46) TSHRTACR1CCR3HRH3ALDH1A1
Hydrochloric Acid SCHEMBL3747861 0.83 TSHR (0.45) TSHRTACR1CCR3HRH3ALDH1A1
SCHEMBL3742781 0.81 GHSR (0.65) GHSRTACR1CCR3
SCHEMBL13044689 0.80 HRH3 (0.43) TSHRGHSRCCR3HRH3ALDH1A1
SCHEMBL13044855 0.80 TSHR (0.42) TSHRGHSRTACR1CCR3ALDH1A1

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 TSHR 47/4885GHSR 2/4885TACR1 56/4885

“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.