SCHEMBL8490002

SCHEMBL8490002

CCCCN(CCCC)CC(CCC)CCS

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.33
PLA2G2A P14555 1/20 0.33
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL8490026 0.92 ALDH1A1 (0.34) PLA2G1BPLA2G2AKDM4EMAPK1TDP1
SCHEMBL8493927 0.88 ALDH1A1 (0.38) PLA2G1BPLA2G2AKDM4EMAPK1TDP1
SCHEMBL8491167 0.88
SCHEMBL8494674 0.86 PLA2G1B (0.34) PLA2G1BPLA2G2AKDM4EMAPK1TDP1
SCHEMBL8494237 0.84 ALDH1A1 (0.34) PLA2G1BPLA2G2ATDP1
SCHEMBL8495409 0.81 PLA2G1B (0.36) PLA2G1BPLA2G2A
SCHEMBL15534875 0.79 PLA2G1B (0.44) PLA2G1BPLA2G2ATDP1
SCHEMBL27402666 0.78 PLA2G1B (0.44) PLA2G1BPLA2G2A
SCHEMBL8496729 0.78 ALDH1A1 (0.35) PLA2G1BPLA2G2AKDM4EMAPK1TDP1
SCHEMBL8494696 0.78 PLA2G1B (0.34) PLA2G1BPLA2G2AKDM4EMAPK1TDP1

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-0676237-B1 Modified ion exchange resins and use thereof MITSUBISHI CHEM CORP (JP) 1999-03-17 EP disclosed
US-5589517-A N,N-DI-SUBSTITITUTED MERCAPTOALKYLAMINE SULFONIC ACID ION EXCHANGE RESIN AS CATALYST FOR CONDENSATION REACTION OF A PHENOL AND A KETONE TO PRODUCE A BISPHENOL MITSUBISHI CHEMICAL CORPORATION (JP) 1996-12-31 US disclosed
EP-0676237-A1 Modified ion exchange resins and use thereof MITSUBISHI CHEMICAL CORPORATION (JP) 1995-10-11 EP disclosed