SCHEMBL8553502

SCHEMBL8553502

Cc1c(CCCCC2CCNCC2)ccc2[nH]c(COc3ccc(Cl)cc3)nc12

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 14/20 0.48
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
DHODH Q02127 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
SLC6A4 P31645 1/20 0.36
TERT O14746 1/20 0.35
DGAT2 Q96PD7 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
SCHEMBL8550284 0.99 NPY1R (0.47) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8554215 0.97 NPY1R (0.49) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8554458 0.90 NPY1R (0.47) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8551656 0.89 NPY1R (0.50) NPY1R
SCHEMBL8556235 0.87 NPY1R (0.48) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8554556 0.86 NPY1R (0.51) NPY1R
SCHEMBL8552622 0.84 NPY1R (0.49) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8551998 0.84 NPY1R (0.49) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8551336 0.83 GPR119 (0.47) NPY1RDGAT2
SCHEMBL8554128 0.82 RAB9A (0.46) NPC1POLBRAB9ASMN1; SMN2TDP1

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