SCHEMBL8553041

SCHEMBL8553041

Cc1c(CCC(C)CN2CCCCC2)ccc2[nH]c(COc3ccc(Cl)cc3)nc12

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
DGAT2 Q96PD7 1/20 0.40
SIGMAR1 Q99720 2/20 0.36
HRH3 Q9Y5N1 9/20 0.35
NPY1R P25929 4/20 0.35
ACHE P22303 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
SCHEMBL8556024 0.85 RAB9A (0.44) RAB9ANPC1POLBSMN1; SMN2TDP1
SCHEMBL8551414 0.83 RAB9A (0.42) RAB9ANPC1POLBSMN1; SMN2TDP1
Hydrochloric Acid SCHEMBL8551426 0.82 RAB9A (0.42) RAB9ANPC1POLBSMN1; SMN2TDP1
SCHEMBL8552889 0.79 RAB9A (0.42) RAB9ANPC1POLBSMN1; SMN2TDP1
SCHEMBL8550273 0.79 RAB9A (0.42) RAB9ANPC1POLBSMN1; SMN2TDP1
SCHEMBL8552242 0.79 RAB9A (0.42) RAB9ANPC1POLBSMN1; SMN2TDP1
SCHEMBL8557775 0.78 RAB9A (0.42) RAB9ANPC1POLBSMN1; SMN2TDP1
SCHEMBL8553401 0.78 RAB9A (0.41) RAB9ANPC1POLBSMN1; SMN2TDP1
SCHEMBL8553406 0.77 RAB9A (0.40) RAB9ANPC1POLBSMN1; SMN2TDP1
SCHEMBL8552916 0.77 RAB9A (0.40) RAB9ANPC1POLBSMN1; 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