SCHEMBL16623344

SCHEMBL16623344

Cc1ccc(C(=O)N(C)c2ccc(-c3cn4cccnc4n3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.67
KDM4E B2RXH2 8/20 0.67
ALDH1A1 P00352 8/20 0.67
NPC1 O15118 7/20 0.67
GAA P10253 7/20 0.67
KMT2A Q03164 4/20 0.67
MEN1 O00255 3/20 0.67
SMN1; SMN2 Q16637 4/20 0.59
MAPT P10636 3/20 0.59
GLA P06280 6/20 0.57
HPGD P15428 5/20 0.57
HSD17B10 Q99714 4/20 0.57
CYP1A2 P05177 2/20 0.57
TP53 P04637 4/20 0.57
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
POLB P06746 2/20 0.51

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
SCHEMBL19806498 0.85 RAB9A (0.63) RAB9AKDM4EALDH1A1NPC1GAA
SCHEMBL17626882 0.82 ALDH1A1 (1.00) RAB9AKDM4EALDH1A1NPC1GAA
SCHEMBL2192378 0.79 MAPT (0.71) RAB9AKDM4EALDH1A1NPC1GAA
SCHEMBL17750391 0.78 RAB9A (0.84) RAB9AKDM4EALDH1A1NPC1GAA
SCHEMBL18924331 0.77 RAB9A (0.54) RAB9AKDM4EALDH1A1NPC1GAA
SCHEMBL7050974 0.77 KDM4E (0.70) RAB9AKDM4EALDH1A1NPC1GAA
SCHEMBL15101484 0.76 RAB9A (0.68) RAB9AKDM4EALDH1A1NPC1GAA
SCHEMBL1494906 0.73 RAB9A (1.00) RAB9AKDM4EALDH1A1NPC1GAA
SCHEMBL25491787 0.72 HSD17B1 (0.59) RAB9AKDM4EALDH1A1NPC1KMT2A
SCHEMBL17750395 0.72 ALDH1A1 (0.75) RAB9AKDM4EALDH1A1NPC1GAA

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
EP-2338059-B1 Ligands for aggregated tau molecules WISTA LAB LTD (SG) 2015-04-08 EP disclosed