SCHEMBL13565327

SCHEMBL13565327

Cc1c(N2CC(C)OC(C)C2)ccc(NCCCCCNS(=O)(=O)C(C)(C)C)c1F

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.34
KDM4E B2RXH2 2/20 0.32
HTT P42858 1/20 0.32
LMNA P02545 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
BRD4 O60885 1/20 0.31
USP30 Q70CQ3 1/20 0.31

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
SCHEMBL17090442 1.00 NPY5R (0.34) NPY5RKDM4EHTTLMNATRPV1
SCHEMBL11935630 0.91 NPY5R (0.35) NPY5RKDM4ELMNABRD4
SCHEMBL11941032 0.91 NPY5R (0.35) NPY5RKDM4ELMNABRD4
SCHEMBL17090445 0.89 NPY5R (0.33) NPY5RKDM4EHTTLMNATRPV1
SCHEMBL13565189 0.89 NPY5R (0.33) NPY5RKDM4EHTTLMNATRPV1
SCHEMBL17090277 0.86 GRIA1 (0.37) NPY5RKDM4EHTTLMNATRPV1
SCHEMBL13565977 0.86 GRIA1 (0.37) NPY5RKDM4EHTTLMNATRPV1
SCHEMBL10134490 0.86 KMT2A (0.39) KDM4ELMNATRPV1
SCHEMBL10115104 0.86 KMT2A (0.39) KDM4ELMNATRPV1
SCHEMBL17090546 0.85 NPY5R (0.35) NPY5RKDM4EHTTLMNATRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8299265-B2 Amine derivatives having NPY Y5 receptor antagonistic activity and the uses thereof SHIONOGI & CO., LTD. (JP) 2012-10-30 US disclosed