SCHEMBL7548352

SCHEMBL7548352

FC(F)(F)c1cccc(CCI)c1.[Zn]

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.65
MIF P14174 2/20 0.54
IDO1 P14902 2/20 0.53
HTR2A P28223 1/20 0.51
HTR2C P28335 1/20 0.51
HTR2B P41595 1/20 0.51
HDAC1 Q13547 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
ACP3 P15309 1/20 0.50
DAO P14920 2/20 0.49
MAOB P27338 3/20 0.48
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
ALOX12 P18054 1/20 0.46
CASP1 P29466 1/20 0.46
HSD17B10 Q99714 1/20 0.46
S1PR1 P21453 1/20 0.46

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
SCHEMBL3624339 0.98 TAAR1 (0.67) TAAR1MIFIDO1HTR2AHTR2C
SCHEMBL386982 0.87 TAAR1 (0.62) TAAR1MIFIDO1HTR2AHTR2C
SCHEMBL156738 0.82 TAAR1 (0.67) TAAR1MIFIDO1HTR2AHTR2C
SCHEMBL8069977 0.82 TAAR1 (0.60) TAAR1MIFIDO1HTR2AHTR2C
SCHEMBL11383498 0.81 TAAR1 (0.65) TAAR1MIFIDO1HTR2AHTR2C
SCHEMBL14549528 0.80 TAAR1 (0.75) TAAR1MIFIDO1HTR2AHTR2C
SCHEMBL12040551 0.79 TAAR1 (0.62) TAAR1MIFIDO1HTR2AHTR2C
SCHEMBL1045499 0.79 TAAR1 (0.62) TAAR1MIFIDO1HTR2AHTR2C
SCHEMBL2096851 0.78 TAAR1 (0.67) TAAR1MIFIDO1HTR2AHTR2C
SCHEMBL156739 0.78 TAAR1 (0.67) TAAR1MIFIDO1HTR2AHTR2C

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
US-6482990-B1 Prostaglandin E analogues TAISHO PHARMACEUTICAL CO., LTD. (JP) 2002-11-19 US disclosed
EP-1211241-A1 PROSTAGLANDIN E ANALOGUES TAISHO PHARMACEUTICAL CO., LTD (JP) 2002-06-05 EP disclosed