SCHEMBL7959050

SCHEMBL7959050

Cn1c(COc2ccc(Cl)cc2)c(C(=O)C(=O)N2CCN(C3CCCCC3)CC2)c2ccccc21

nearest known ligand 0.87

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 11/20 0.87
SMN1; SMN2 Q16637 2/20 0.49
KMT2A Q03164 1/20 0.45
TACR1 P25103 1/20 0.44
USP2 O75604 1/20 0.44
TP53 P04637 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HRH3 Q9Y5N1 1/20 0.41

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
SCHEMBL7963164 0.93 NPY1R (1.00) NPY1RSMN1; SMN2KMT2AHRH3
SCHEMBL7956905 0.89 NPY1R (0.83) NPY1RKMT2A
SCHEMBL7949187 0.86 NPY1R (0.79) NPY1RSMN1; SMN2KMT2AKDM4EHRH3
SCHEMBL7957295 0.86 NPY1R (0.87) NPY1RSMN1; SMN2KMT2A
SCHEMBL7956724 0.84 NPY1R (0.75) NPY1RKMT2ATP53
SCHEMBL7963219 0.84 NPY1R (0.75) NPY1RSMN1; SMN2KMT2AKDM4E
SCHEMBL7957128 0.84 NPY1R (0.84) NPY1RSMN1; SMN2HRH3
SCHEMBL7957137 0.84 NPY1R (0.69) NPY1RKMT2ATACR1KDM4EHRH3
SCHEMBL7958925 0.83 NPY1R (0.71) NPY1RKMT2AKDM4E
SCHEMBL7958736 0.83 NPY1R (0.71) NPY1RSMN1; SMN2KMT2ATP53

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-6245761-B1 NERVOUS SYSTEM, CARDIOVASCULAR AND RESPIRATORY SYSTEM DISORDERS ELI LILLY AND COMPANY 2001-06-12 US disclosed