SCHEMBL13044525

SCHEMBL13044525

CN1CCN(C(C(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ccc3ccccc3c2)CC1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 2/20 0.68
ABCB1 P08183 5/20 0.45
TACR1 P25103 4/20 0.43
TACR3 P29371 1/20 0.40
CCR3 P51677 4/20 0.39
SCN5A Q14524 1/20 0.39
SCN9A Q15858 1/20 0.39
MAPT P10636 2/20 0.38
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.38
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38

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
SCHEMBL3634225 0.86 GHSR (0.67) GHSRABCB1TACR1TACR3CCR3
SCHEMBL13044524 0.85 GHSR (0.48) GHSRABCB1MAPTALDH1A1KMT2A
SCHEMBL3639856 0.85 GHSR (0.52) GHSRABCB1CCR3ALDH1A1KMT2A
SCHEMBL3638183 0.84 GHSR (0.71) GHSRABCB1TACR1TACR3CCR3
SCHEMBL3639852 0.83 GHSR (0.62) GHSRABCB1TACR1TACR3KMT2A
SCHEMBL13044526 0.83 GHSR (0.61) GHSRTACR1MAPTALDH1A1KMT2A
SCHEMBL3636800 0.83 GHSR (0.61) GHSRTACR1MAPTALDH1A1KDM4E
Hydrochloric Acid SCHEMBL3638707 0.82 GHSR (0.60) GHSRTACR1MAPTALDH1A1KMT2A
Hydrochloric Acid SCHEMBL3636980 0.82 GHSR (0.74) GHSRABCB1TACR1TACR3
SCHEMBL3637124 0.82 GHSR (0.68) GHSRTACR1TACR3MAPTALDH1A1

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 2/4885ABCB1 2178/4885TACR1 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.