SCHEMBL5334148

SCHEMBL5334148

CN1CCN(Cc2c(CSc3ccccc3)[nH]c3ccc(Cl)cc23)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.44
ALDH1A1 P00352 5/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
KDM4E B2RXH2 4/20 0.43
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MC4R P32245 1/20 0.40
LMNA P02545 1/20 0.40
IDE P14735 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
HTR6 P50406 2/20 0.39
CHRNA7 P36544 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
GRIN2B Q13224 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
SCHEMBL5331577 0.87 MPO (0.48) POLBALDH1A1KDM4EGAALMNA
SCHEMBL5332260 0.87 POLB (0.44) POLBALDH1A1MEN1KMT2AKDM4E
SCHEMBL5329097 0.87 DRD2 (0.52) POLBALDH1A1MEN1KMT2AKDM4E
SCHEMBL5371032 0.85 ALDH1A1 (0.47) POLBALDH1A1MEN1KMT2AKDM4E
SCHEMBL5329102 0.85 KDM4E (0.46) POLBALDH1A1MEN1KMT2AKDM4E
SCHEMBL5367989 0.84 ALDH1A1 (0.46) POLBALDH1A1MEN1KMT2AKDM4E
SCHEMBL5379284 0.84 ALDH1A1 (0.46) POLBALDH1A1MEN1KMT2AKDM4E
SCHEMBL5333140 0.79 HTR6 (0.48) POLBALDH1A1MEN1KMT2AKDM4E
SCHEMBL947686 0.79 POLB (0.64) POLBALDH1A1MEN1KMT2AKDM4E
SCHEMBL5332148 0.78 KMT2A (0.44) POLBALDH1A1MEN1KMT2AKDM4E

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
WO-2007046112-A1 ARYLTHIOETHER TRYPTAMINE DERIVATIVES AS FUNCTIONAL 5-HT6 LIGANDS SUVEN LIFE SCIENCES INC. (IN) 2007-04-26 WO claimed