SCHEMBL15529600

SCHEMBL15529600

CCCCCCCC[Sn](Cl)(CCCCCCCC)c1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.40
HSP90AA1 P07900 1/20 0.40
MMP2 P08253 1/20 0.40
MC4R P32245 1/20 0.40
RAD52 P43351 1/20 0.40
HTR7 P34969 1/20 0.37
GAA P10253 1/20 0.36
TRPA1 O75762 1/20 0.33
KCNH3 Q9ULD8 1/20 0.33
GRM2 Q14416 1/20 0.33
HPGD P15428 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
TLR8 Q9NR97 1/20 0.32
GCGR P47871 2/20 0.31
ICMT O60725 1/20 0.31
ALB P02768 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
SCHEMBL15375274 0.81 NPC1 (0.39)
SCHEMBL5702219 0.72 HTR7 (0.41) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL5701840 0.72 HTR7 (0.41) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL8916517 0.72 LTA4H (0.35)
SCHEMBL1096789 0.72 HTR7 (0.41) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL2615717 0.66 ESR1 (0.63) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL2615718 0.66 ESR1 (0.63) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL9717309 0.66 ESR1 (0.63) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL3941872 0.66 ESR1 (0.63) PSMD14HSP90AA1MMP2MC4RRAD52
SCHEMBL13564082 0.66 ESR1 (0.63) PSMD14HSP90AA1MMP2MC4RRAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013167585-A2 RECYCLING OF ORGANOTIN COMPOUNDS UNIVERSITEIT ANTWERPEN (BE) 2013-11-14 WO claimed
WO-2013167585-A2 RECYCLING OF ORGANOTIN COMPOUNDS UNIVERSITEIT ANTWERPEN (BE) 2013-11-14 WO disclosed