SCHEMBL7958736

SCHEMBL7958736

Cn1c(COc2ccc(Cl)cc2)c(C(=O)C(=O)N2CCCC(C(N)=O)C2)c2ccccc21

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 12/20 0.71
HSD17B10 Q99714 2/20 0.45
GLA P06280 1/20 0.45
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 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
SCHEMBL7963219 0.90 NPY1R (0.75) NPY1RHSD17B10KMT2AALDH1A1SMN1; SMN2
SCHEMBL7956905 0.87 NPY1R (0.83) NPY1RKMT2AALDH1A1MEN1NPC1
SCHEMBL8802019 0.86 NPY1R (0.71) NPY1RHSD17B10TP53KMT2AALDH1A1
SCHEMBL7949187 0.83 NPY1R (0.79) NPY1RKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL7963164 0.83 NPY1R (1.00) NPY1RKMT2ASMN1; SMN2
SCHEMBL7959050 0.83 NPY1R (0.87) NPY1RTP53KMT2ASMN1; SMN2
SCHEMBL7956724 0.81 NPY1R (0.75) NPY1RTP53KMT2A
SCHEMBL7958925 0.80 NPY1R (0.71) NPY1RKMT2A
SCHEMBL7958879 0.79 NPY1R (0.61) NPY1RGAAKMT2AALDH1A1SMN1; SMN2
SCHEMBL7959104 0.79 NPY1R (0.73) NPY1RKMT2ASMN1; SMN2MEN1

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