SCHEMBL540842

SCHEMBL540842

C=[Zr](C1C(CCC)=Cc2c(-c3cccc4ccccc34)cccc21)C1C(CCC)=Cc2c(-c3cccc4ccccc34)cccc21

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.33
SLC6A4 P31645 3/20 0.33
DRD2 P14416 1/20 0.33
CNR1 P21554 2/20 0.32
ALOX15 P16050 2/20 0.31
CNR2 P34972 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
SCHEMBL7627579 0.89 SLC6A4 (0.33) HTR7SLC6A4DRD2CNR1ALOX15
SCHEMBL5582112 0.85 ALOX15 (0.32) HTR7SLC6A4DRD2CNR1ALOX15
SCHEMBL5890133 0.84 ALOX15 (0.32) HTR7SLC6A4DRD2CNR1ALOX15
SCHEMBL28576605 0.83 HPRT1 (0.33) SLC6A4DRD2CNR1
SCHEMBL5688274 0.81 CNR1 (0.36) HTR7SLC6A4DRD2CNR1ALOX15
SCHEMBL27492404 0.81 CNR1 (0.40) HTR7SLC6A4DRD2CNR1ALOX15
SCHEMBL27594164 0.80 CNR1 (0.41) HTR7SLC6A4DRD2CNR1ALOX15
Hydrochloric Acid SCHEMBL27478889 0.80 SLC6A4 (0.36) HTR7SLC6A4DRD2CNR1ALOX15
SCHEMBL4065890 0.80 HTR7 (0.32) HTR7SLC6A4DRD2CNR1ALOX15
Hydrochloric Acid SCHEMBL3275849 0.79 SLC6A4 (0.31) SLC6A4

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
EP-2415792-A1 COPOLYMER OF OLEFIN AND CONJUGATED DIENE, AND PROCESS FOR PRODUCING SAME Mitsui Chemicals, Inc. (JP) 2012-02-08 EP disclosed