SCHEMBL8552560

SCHEMBL8552560

Clc1ccc(OCc2nc3c(CCCC4CCNCC4)ccc(OCc4ccccc4)c3[nH]2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 8/20 0.45
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
PRMT5 O14744 6/20 0.39
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
KDM1A O60341 1/20 0.37
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37

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
SCHEMBL8553571 0.85 NPY1R (0.45) NPY1RPRMT5NPC1POLBRAB9A
SCHEMBL8554215 0.77 NPY1R (0.49) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8551998 0.77 NPY1R (0.49) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8555280 0.76 PRMT5 (0.48) PRMT5TDP1
SCHEMBL8556235 0.76 NPY1R (0.48) NPY1RPRMT5NPC1POLBRAB9A
SCHEMBL8553502 0.74 NPY1R (0.48) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8553288 0.74 NPY1R (0.53) NPY1R
SCHEMBL8550284 0.74 NPY1R (0.47) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8554458 0.74 NPY1R (0.47) NPY1RPRMT5NPC1POLBRAB9A
SCHEMBL8554991 0.73 NPY1R (0.42) NPY1RNPC1POLBRAB9ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871442-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1998-10-21 EP disclosed
WO-1997025041-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-07-17 WO disclosed