SCHEMBL9759882

SCHEMBL9759882

C=CCC[Sn](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.33
ALDH1A1 P00352 3/20 0.33
IDH1 O75874 1/20 0.33
CYP1A2 P05177 1/20 0.32
HPGD P15428 2/20 0.31
HSD17B10 Q99714 2/20 0.31
ACHE P22303 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL703693 0.76 ALDH1A1 (0.36) TSHRALDH1A1CYP2C19HTT
SCHEMBL15529704 0.72 ALDH1A1 (0.37) TSHRALDH1A1IDH1HPGD
SCHEMBL11316262 0.70 HIF1A (0.36) TSHRALDH1A1
SCHEMBL25359877 0.69 TP53 (0.38) TSHRALDH1A1HPGDACHEKDM4E
SCHEMBL27794656 0.69 TDP1 (0.40) TSHRALDH1A1
SCHEMBL29200159 0.69 CALM1 (0.35)
SCHEMBL2526309 0.69 IDO1 (0.38)
SCHEMBL10932716 0.69 TP53 (0.38) TSHRALDH1A1HPGDACHEKDM4E
SCHEMBL4619452 0.67 ALDH1A1 (0.36) TSHRALDH1A1CYP2C19HTT
SCHEMBL390267 0.67 ALDH1A1 (0.36) TSHRALDH1A1CYP2C19HTT

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-5006554-A Applying tributenyltin bromides to boat hulls as antifouling agents; high speed degradation to nontoxic products THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1991-04-09 US disclosed