SCHEMBL4053412

SCHEMBL4053412

C=C=[Ru](Cl)(Cl)(c1ccccc1)(=c1n(C2CCCCC2)ccn1C1CCCCC1)=c1n(C2CCCCC2)ccn1C1CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.33
KDM4E B2RXH2 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
ALDH1A1 P00352 3/20 0.30
MCOLN3 Q8TDD5 1/20 0.30
DRD2 P14416 1/20 0.30
DRD4 P21917 1/20 0.30
DRD3 P35462 1/20 0.30
IL4I1 Q96RQ9 1/20 0.30

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
SCHEMBL6402903 0.72
SCHEMBL2144267 0.66 SLC18A3 (0.34) SLC18A3KDM4ENPSR1ALDH1A1IL4I1
Hydrochloric Acid SCHEMBL1975854 0.65 SLC18A3 (0.33) SLC18A3KDM4ENPSR1ALDH1A1IL4I1
Hydrochloric Acid SCHEMBL4053411 0.65 SLC18A3 (0.33) SLC18A3KDM4ENPSR1ALDH1A1IL4I1
SCHEMBL1172657 0.64 SLC18A3 (0.33) SLC18A3KDM4ENPSR1ALDH1A1IL4I1
SCHEMBL819175 0.63 IL4I1 (0.34) SLC18A3KDM4ENPSR1ALDH1A1DRD2
SCHEMBL8250269 0.59 SLC18A3 (0.43) SLC18A3KDM4EALDH1A1DRD2DRD4
SCHEMBL2144270 0.59 SLC18A3 (0.33) SLC18A3KDM4ENPSR1ALDH1A1IL4I1
SCHEMBL28615075 0.58 DRD2 (0.66) SLC18A3NPSR1ALDH1A1DRD2DRD4
SCHEMBL4607064 0.58 SLC18A3 (0.36) SLC18A3KDM4ENPSR1ALDH1A1IL4I1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9601726-B2 Sealing material for secondary battery and sealing material composition for secondary battery ZEON CORPORATION (JP) 2017-03-21 US disclosed
US-20150188099-A1 SEALING MATERIAL FOR SECONDARY BATTERY AND SEALING MATERIAL COMPOSITION FOR SECONDARY BATTERY ZEON CORPORATION (JP) 2015-07-02 US disclosed
EP-1655321-B1 POLYMERIZABLE COMPOSITIONS AND MOLDED ARTICLES PRODUCED BY USING THE SAME ZEON CORP (JP) 2012-11-21 EP disclosed
EP-1652885-B1 POLYMERIZABLE COMPOSITION AND FORMED ARTICLE USING THE SAME ZEON CORP (JP) 2009-03-11 EP disclosed
US-7465773-B2 Polymerizable composition and formed article using the same ZEON CORPORATION (JP) 2008-12-16 US disclosed
US-7381782-B2 Polymerizable composition and molded articles produced by using the same ZEON CORPORATION (JP) 2008-06-03 US disclosed
US-20060258828-A1 Polymerizable composition and molded articles produced by using the same ZEON CORPORATION (JP) 2006-11-16 US disclosed
US-20060211809-A1 Polymerizable composition and formed article using the same ZEON CORPORATION (JP) 2006-09-21 US disclosed
US-20060154099-A1 Multilayer body and method for producing same ZEON CORPORATION (JP) 2006-07-13 US disclosed
EP-1655321-A1 POLYMERIZABLE COMPOSITIONS AND MOLDED ARTICLES PRODUCED BY USING THE SAME Zeon Corporation (JP) 2006-05-10 EP disclosed
EP-1652885-A1 POLYMERIZABLE COMPOSITION AND FORMED ARTICLE USING THE SAME Zeon Corporation (JP) 2006-05-03 EP disclosed
EP-1640153-A1 MULTILAYER BODY AND METHOD FOR PRODUCING SAME Zeon Corporation (JP) 2006-03-29 EP disclosed