SCHEMBL4473142

SCHEMBL4473142

C1=CC([Gd]C2C=Cc3ccccc32)c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.40
HTR6 P50406 1/20 0.39
SIGMAR1 Q99720 6/20 0.33
KDM4E B2RXH2 2/20 0.32
CYP2D6 P10635 2/20 0.32
BRD4 O60885 1/20 0.32
CCL2 P13500 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CHRM2 P08172 1/20 0.32
CYP3A4 P08684 1/20 0.32
CHRM1 P11229 1/20 0.32
DRD2 P14416 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
NFKB1 P19838 1/20 0.32
CHRM3 P20309 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2C P28335 1/20 0.32
ADRA1A P35348 1/20 0.32

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
SCHEMBL4398162 0.82 RET (0.34) HTR2AHTR6KDM4ECYP2D6BRD4
SCHEMBL30132686 0.73 HTR2A (0.41) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL4927009 0.73 HTR2A (0.41) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL4927002 0.73 HTR2A (0.41) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL2679503 0.73 HTR2A (0.41) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL5698322 0.72 HTR2A (0.44) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Fluoride SCHEMBL5183514 0.71 HTR2A (0.40) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Lithium Ion SCHEMBL29767570 0.71 HTR2A (0.40) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Fluoride SCHEMBL7560410 0.71 HTR2A (0.40) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Fluoride SCHEMBL28997532 0.71 HTR2A (0.40) HTR2AHTR6SIGMAR1KDM4ECYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479935-B2 Polymerization processes for the production of cis-1,4-polydienes BRIDGESTONE CORPORATION (JP) 2025-11-25 US disclosed
US-20230089837-A1 POLYMERIZATION PROCESSES FOR THE PRODUCTION OF CIS-1,4-POLYDIENES BRIDGESTONE CORPORATION (JP) 2023-03-23 US disclosed
US-20230038639-A1 POLYMERIZATION PROCESSES FOR THE PRODUCTION OF CIS-1,4-POLYDIENES BRIDGESTONE CORPORATION (JP) 2023-02-09 US disclosed
WO-2021133818-A1 POLYMERIZATION PROCESSES FOR THE PRODUCTION OF CIS-1,4-POLYDIENES BRIDGESTONE CORPORATION (JP) 2021-07-01 WO disclosed
WO-2021133819-A1 POLYMERIZATION PROCESSES FOR THE PRODUCTION OF CIS-1,4-POLYDIENES BRIDGESTONE CORPORATION (JP) 2021-07-01 WO disclosed
EP-2797969-B1 BULK POLYMERIZATION PROCESS FOR PRODUCING POLYDIENES BRIDGESTONE CORP (JP) 2016-02-10 EP disclosed
US-9228037-B2 Bulk polymerization process for producing polydienes BRIDGESTONE CORPORATION (JP) 2016-01-05 US disclosed
EP-2017280-B1 METALLOCENE COMPLEX AND POLYMERIZATION CATALYST COMPOSITION CONTAINING THE SAME RIKEN (JP) 2015-01-07 EP disclosed
US-20140378630-A1 Bulk Polymerization Process For Producing Polydienes BRIDGESTONE CORPORATION (JP) 2014-12-25 US disclosed
EP-2017280-A1 METALLOCENE COMPLEX AND POLYMERIZATION CATALYST COMPOSITION CONTAINING THE SAME Riken (JP) 2009-01-21 EP disclosed