SCHEMBL27552149

SCHEMBL27552149

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

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 9/20 0.47
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
TP53 P04637 1/20 0.40
GAA P10253 1/20 0.39
HSD17B10 Q99714 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
GLA P06280 1/20 0.37
KMT2A Q03164 2/20 0.36
LTA4H P09960 1/20 0.35

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
SCHEMBL27494327 0.90 NPY1R (0.50) NPY1RALDH1A1MAPTTP53HSD17B10
SCHEMBL27494317 0.84 NPY1R (0.60) NPY1RTP53
SCHEMBL27478238 0.82 NPY1R (0.51) NPY1R
SCHEMBL27493923 0.80 NPY1R (0.66) NPY1RSMN1; SMN2
SCHEMBL27476950 0.80 NPY1R (0.52) NPY1RALDH1A1TP53GAAKMT2A
SCHEMBL27479802 0.79 NPY1R (0.51) NPY1RALDH1A1GAA
SCHEMBL7958736 0.78 NPY1R (0.71) NPY1RALDH1A1TP53GAAHSD17B10
SCHEMBL27479056 0.77 NPY1R (0.47) NPY1RSMN1; SMN2KMT2A
SCHEMBL27479801 0.76 NPY1R (0.53) NPY1RALDH1A1TP53GAASMN1; SMN2
Hydrochloric Acid SCHEMBL27478640 0.76 NPY1R (0.48) NPY1RALDH1A1MAPTGAASMN1; SMN2

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
CN-1173867-A Indolyl neuropeptide Y receptor antagonists LILLY CO ELI (US) 1998-02-18 CN disclosed