SCHEMBL9619683

SCHEMBL9619683

CC(C)(C[Sn](Cl)(CC(C)(C)c1ccccc1)c1ccccc1C(F)(F)F)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.38
ALDH1A1 P00352 2/20 0.35
TSHR P16473 1/20 0.35
HSD11B1 P28845 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
IDO1 P14902 1/20 0.30
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 1/20 0.30
TACR1 P25103 1/20 0.30
POLQ O75417 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
SCHEMBL9619891 0.80 TAAR1 (0.37) TAAR1ALDH1A1TSHRHSD11B1IDO1
SCHEMBL9619708 0.75 KCNA5 (0.39) TAAR1ALDH1A1
SCHEMBL9619925 0.75 TAAR1 (0.38) TAAR1
SCHEMBL9619886 0.75 TAAR1 (0.33) TAAR1ALDH1A1TSHR
SCHEMBL9619887 0.75 TAAR1 (0.33) TAAR1ALDH1A1TSHRHSD11B1
SCHEMBL10713189 0.72 TAAR1 (0.52) TAAR1ALDH1A1TSHR
SCHEMBL9619722 0.71 HSP90AA1 (0.34) KDM4E
SCHEMBL9619759 0.69 PPARG (0.35) TAAR1ALDH1A1IDO1
SCHEMBL9619674 0.68 PPARG (0.36) TAAR1ALDH1A1IDO1
SCHEMBL8166939 0.66 ALDH1A1 (0.39) ALDH1A1TSHRHSD11B1IDO1

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