SCHEMBL28239202

SCHEMBL28239202

CC1C(c2ccccc2C2=Cc3ccccc3C2C)=Cc2ccccc21.Cl[Zr]Cl

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.42
DRD4 P21917 5/20 0.42
BRD4 O60885 1/20 0.34
CCL2 P13500 1/20 0.34
GPR3 P46089 2/20 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
SCHEMBL29672901 0.92 DRD2 (0.46) DRD2DRD4BRD4CCL2GPR3
Hydrochloric Acid SCHEMBL7183660 0.89 DRD2 (0.44) DRD2DRD4BRD4CCL2GPR3
SCHEMBL19689123 0.84 DRD2 (0.35) DRD2DRD4BRD4CCL2
SCHEMBL4384850 0.75 DRD2 (0.38) DRD2DRD4BRD4CCL2
Hydrochloric Acid SCHEMBL8505901 0.74 DRD2 (0.34) DRD2DRD4
SCHEMBL8506487 0.73 DRD2 (0.33) DRD2DRD4
Hydrochloric Acid SCHEMBL17836078 0.72 CYP11B1 (0.40) DRD2DRD4BRD4CCL2
SCHEMBL5475152 0.70 DRD2 (0.40) DRD2DRD4BRD4CCL2
SCHEMBL27547600 0.69 DRD2 (0.37) DRD2DRD4BRD4CCL2
SCHEMBL30177268 0.68 DRD2 (0.39) DRD2DRD4BRD4CCL2

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
CN-104093749-B Catalyst composition and process for preparing the same 沙特基础工业公司 2018-08-07 CN disclosed