SCHEMBL20440936

SCHEMBL20440936

F[Zr](F)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.41
HTR2A P28223 2/20 0.41
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
POLB P06746 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
ACHE P22303 3/20 0.33
BCHE P06276 2/20 0.33
CHRM2 P08172 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33
CHRM1 P11229 1/20 0.33
DRD1 P21728 1/20 0.33

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
SCHEMBL7602124 0.74 GPR3 (0.46) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL8755331 0.70 HTR2A (0.38) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL29797969 0.69 GPR3 (0.46) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL7562005 0.69 GPR3 (0.46) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL4359049 0.69 GPR3 (0.46) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL22228416 0.68 GPR3 (0.33) GPR3
SCHEMBL29950614 0.67 GPR3 (0.50) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL524603 0.67 GPR3 (0.50) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL825558 0.65 HTR2A (0.55) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL1107108 0.65 GPR3 (0.48) GPR3HTR2AHDAC3HDAC4HDAC7

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
US-10040883-B2 Multimodal polyolefin resin and molded product prepared therefrom DAELIM INDUSTRIAL CO., LTD. (KR) 2018-08-07 US disclosed