SCHEMBL9192596

SCHEMBL9192596

Clc1ccc2c(OCCCCCCCOC3CCCCO3)cccc2n1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 11/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
KDM4C Q9H3R0 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
CYBB P04839 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
NOX5 Q96PH1 1/20 0.40
P2RX7 Q99572 1/20 0.38
P2RX3 P56373 1/20 0.36

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
SCHEMBL9190502 0.75 NCF1 (0.62) NCF1CYBBNOX5
SCHEMBL9189479 0.75 NCF1 (0.62) NCF1CYBBNOX5
SCHEMBL12959495 0.74 KDM4C (0.45) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL5217641 0.73 KDM4C (0.49) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL28619035 0.73 MEN1 (0.52) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL6000386 0.72 MEN1 (0.48) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL9179491 0.71 ALDH1A1 (0.48) NCF1CYBBNOX5P2RX7
SCHEMBL3114026 0.71 KDM4C (0.46) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL8350940 0.71 MEN1 (0.50) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL4424832 0.70 MEN1 (0.45) MEN1KMT2AKDM4CL3MBTL1NPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0317188-B1 Heteroaromatic enamide derivatives and their use as pesticides ROUSSEL UCLAF (FR) 1995-09-27 EP disclosed
US-5114940-A Insecticides or anthelmintics from fused ring heterocycles containing amides or thioamides ROUSSEL-UCLAF (FR) 1992-05-19 US disclosed
EP-0317188-A2 Heteroaromatic enamide derivatives and their use as pesticides ROUSSEL UCLAF (FR) 1989-05-24 EP disclosed