SCHEMBL17423119

SCHEMBL17423119

Clc1ccc2c(Cl)c3ccc(Cl)cc3nc2c1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.55
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
NR4A2 P43354 3/20 0.52
ESR1 P03372 1/20 0.49
ESR2 Q92731 1/20 0.49
MPO P05164 1/20 0.47
ACHE P22303 4/20 0.46
BCHE P06276 2/20 0.46
CHRM1 P11229 1/20 0.46
EPHX2 P34913 1/20 0.46
SOS2 Q07890 1/20 0.45
KMT2A Q03164 1/20 0.43
F7 P08709 1/20 0.43
F3 P13726 1/20 0.43
DYRK1A Q13627 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
PIK3CG P48736 1/20 0.42

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
SCHEMBL31500251 0.93 MAOA (0.52) POLBMAOAMAOBNR4A2ESR1
SCHEMBL9709249 0.89 MAOA (0.72) POLBMAOAMAOBNR4A2ESR1
SCHEMBL31500224 0.85 MAOA (0.58) MAOAMAOBNR4A2MPOACHE
SCHEMBL22791812 0.83 LMNA (0.50) POLBMAOAMAOBNR4A2ESR1
SCHEMBL11194565 0.83 KDM4E (0.61) POLBMPOACHECHRM1KMT2A
SCHEMBL13737248 0.83 DHODH (0.44) POLBMAOAMAOBNR4A2ESR1
SCHEMBL28220511 0.81 POLB (0.47) POLBNR4A2ESR1ESR2MPO
SCHEMBL31038657 0.79 KDM4E (0.68) POLBACHECHRM1KMT2AKDM4E
SCHEMBL30603139 0.79 KDM4E (0.68) POLBACHECHRM1KMT2AKDM4E
SCHEMBL2448633 0.79 KDM4E (0.68) POLBACHECHRM1KMT2AKDM4E

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-2016005979-A1 METHODS AND COMPOSITIONS FOR TREATING VIRAL INFECTIONS IN HONEYBEES THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2016-01-14 WO disclosed