SCHEMBL9619728

SCHEMBL9619728

CC(C)(C[Sn](CC(C)(C)c1ccccc1)(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TAAR1 Q96RJ0 2/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
MAPK1 P28482 1/20 0.38
KIF11 P52732 1/20 0.38
CNR2 P34972 1/20 0.38
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 2/20 0.36
SRD5A2 P31213 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
IDH2 P48735 1/20 0.36
MAOB P27338 1/20 0.36
SCN2A Q99250 1/20 0.36
TACR1 P25103 1/20 0.36
VNN1 O95497 1/20 0.36

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
SCHEMBL10716918 0.86 TSHR (0.39) TSHRALDH1A1TAAR1HTR2AHTR2C
Bromide SCHEMBL9619764 0.83 TSHR (0.37) TSHRALDH1A1TAAR1HTR2AHTR2C
SCHEMBL9619923 0.82 TAAR1 (0.50) ALDH1A1TAAR1MAPK1KMT2AMAPT
SCHEMBL9619674 0.78 PPARG (0.36) ALDH1A1TAAR1MEN1KMT2AMAPT
SCHEMBL9619732 0.75 TAAR1 (0.42) TSHRALDH1A1TAAR1MAPK1KIF11
SCHEMBL9619807 0.72 TAAR1 (0.47) TSHRALDH1A1TAAR1MAPK1KMT2A
SCHEMBL9619820 0.71 TAAR1 (0.42) TSHRALDH1A1TAAR1HTR2AHTR2C
SCHEMBL978014 0.71 TSHR (0.48) TSHRALDH1A1TAAR1HTR2AHTR2C
SCHEMBL11683594 0.71 TAAR1 (0.50) ALDH1A1TAAR1MAPK1KMT2AMAPT
SCHEMBL9534416 0.70 TSHR (0.44) TSHRALDH1A1TAAR1HTR2AHTR2C

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