SCHEMBL7960784

SCHEMBL7960784

Cn1c(CNC2CCCCC2)c(CN2CCCCC2)c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 6/20 0.54
ALDH1A1 P00352 7/20 0.53
HSD17B10 Q99714 4/20 0.53
TSHR P16473 2/20 0.53
NPSR1 Q6W5P4 2/20 0.47
LMNA P02545 2/20 0.47
KMT2A Q03164 1/20 0.47
HRH3 Q9Y5N1 2/20 0.47
KDM4E B2RXH2 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALOX15 P16050 1/20 0.45
HPGD P15428 1/20 0.40
RB1 P06400 1/20 0.39
SLC2A1 P11166 1/20 0.39
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
BACE1 P56817 1/20 0.39

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
Hydrochloric Acid SCHEMBL7958855 0.83 NPY1R (0.51) NPY1RALDH1A1HSD17B10TSHRNPSR1
Hydrochloric Acid SCHEMBL7948675 0.78 NPY1R (0.53) NPY1RALDH1A1HSD17B10TSHRNPSR1
SCHEMBL7957280 0.77 NPY1R (0.66) NPY1RALDH1A1HSD17B10TSHRNPSR1
SCHEMBL7965110 0.77 RAB9A (0.55) ALDH1A1HSD17B10TSHRKMT2AKDM4E
Hydrochloric Acid SCHEMBL27495505 0.77 NPY1R (0.52) NPY1RALDH1A1HSD17B10TSHRNPSR1
SCHEMBL7959181 0.76 NPY1R (0.59) NPY1RALDH1A1HSD17B10TSHRNPSR1
SCHEMBL7963648 0.75 NPY1R (0.53) NPY1RALDH1A1HSD17B10TSHRLMNA
SCHEMBL7949099 0.74 NPY1R (0.60) NPY1RALDH1A1HSD17B10TSHRNPSR1
SCHEMBL7963250 0.74 NPY1R (0.60) NPY1RALDH1A1HSD17B10TSHRNPSR1
SCHEMBL7948835 0.73 NPY1R (0.66) NPY1RALDH1A1HSD17B10TSHRNPSR1

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
US-6245761-B1 NERVOUS SYSTEM, CARDIOVASCULAR AND RESPIRATORY SYSTEM DISORDERS ELI LILLY AND COMPANY 2001-06-12 US disclosed
CN-1173867-A Indolyl neuropeptide Y receptor antagonists LILLY CO ELI (US) 1998-02-18 CN disclosed