SCHEMBL9619732

SCHEMBL9619732

CC(C)(C[Sn](CC(C)(C)c1ccccc1)(c1ccc(F)cc1)c1ccc(F)cc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.42
KCNN4 O15554 2/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
ALDH1A1 P00352 2/20 0.33
NR3C2 P08235 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KIF11 P52732 2/20 0.33
MAPK1 P28482 1/20 0.32
CACNA1G O43497 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
NFE2L2 Q16236 1/20 0.31
TSHR P16473 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
SCHEMBL9619923 0.87 TAAR1 (0.50) TAAR1KCNN4ALDH1A1KMT2AMAPK1
SCHEMBL9619804 0.84 TAAR1 (0.41) TAAR1KCNN4PTGDR2ALDH1A1NR3C2
SCHEMBL9619820 0.82 TAAR1 (0.42) TAAR1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL9619797 0.77 TAAR1 (0.38) TAAR1KCNN4NR3C2KIF11NFE2L2
SCHEMBL19441058 0.75 TAAR1 (0.50) TAAR1KCNN4ALDH1A1MEN1LMNA
SCHEMBL9619728 0.75 TSHR (0.41) TAAR1ALDH1A1MEN1KMT2AKIF11
SCHEMBL9619814 0.72 TAAR1 (0.40) TAAR1KCNN4KIF11MAPK1CYP2C19
SCHEMBL9619780 0.72 TAAR1 (0.40) TAAR1MAPK1CYP2C19HIF1A
SCHEMBL9619674 0.72 PPARG (0.36) TAAR1ALDH1A1MEN1LMNAKMT2A
SCHEMBL9619807 0.72 TAAR1 (0.47) TAAR1KCNN4ALDH1A1KMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0214842-B1 ORGANOTIN COMPOUNDS AND PESTICIDES CONTAINING THEM SHIONOGI & CO., LTD. (JP) 1992-02-05 EP disclosed
US-4935408-A Organotin compounds and pesticides containing them SHIONOGI & CO., LTD. (JP) 1990-06-19 US disclosed
US-4774235-A MITICIDES SHIONOGI & CO., LTD. (JP) 1988-09-27 US disclosed
EP-0214842-A2 Organotin compounds and pesticides containing them SHIONOGI & CO., LTD. (JP) 1987-03-18 EP disclosed