SCHEMBL3733869

SCHEMBL3733869

CN1CCN(C(C(=O)N(N)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2ncccc2Cl)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.48
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GPBAR1 Q8TDU6 1/20 0.36
UGCG Q16739 4/20 0.35
CYP3A4 P08684 3/20 0.35
TRPA1 O75762 2/20 0.35
TRPV1 Q8NER1 1/20 0.35
TACR1 P25103 3/20 0.35
CCR3 P51677 1/20 0.34
MET P08581 1/20 0.34
HSP90AA1 P07900 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
PPP1CA P62136 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PSMD14 O00487 1/20 0.33
MMP2 P08253 1/20 0.33

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
SCHEMBL3725764 0.90 GHSR (0.40) GHSRGPBAR1TRPV1TACR1
SCHEMBL3731664 0.84 GHSR (0.63) GHSRLMNASMN1; SMN2TACR1CCR3
Hydrochloric Acid SCHEMBL3728776 0.83 GHSR (0.62) GHSRLMNASMN1; SMN2TACR1CCR3
SCHEMBL3809201 0.83 GHSR (0.43) GHSRLMNASMN1; SMN2TACR1HSP90AA1
SCHEMBL3633463 0.79 GHSR (0.73) GHSRLMNASMN1; SMN2UGCGCYP3A4
SCHEMBL3806409 0.79 GHSR (0.41) GHSRTACR1CCR3
SCHEMBL3804821 0.79 GHSR (0.39) GHSRLMNASMN1; SMN2TACR1CCR3
SCHEMBL3730182 0.77 GHSR (0.43) GHSRLMNASMN1; SMN2TACR1MET
SCHEMBL3813981 0.77 GHSR (0.41) GHSRTACR1MET
SCHEMBL3727091 0.76 GHSR (0.39) GHSRCYP3A4TACR1CCR3MET

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2167466-A1 N-PHENYL HYDRAZIDES AS MODULATORS OF THE GHRELIN RECEPTOR Glaxo Group Limited (GB) 2010-03-31 EP disclosed
WO-2008148853-A1 N-PHENYL HYDRAZIDES AS MODULATORS OF THE GHRELIN RECEPTOR GLAXO GROUP LIMITED (GB) 2008-12-11 WO disclosed