SCHEMBL8103732

SCHEMBL8103732

O=C1CSC(c2cccc(OC(F)(F)C(F)F)c2)N1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.46
PIM1 P11309 1/20 0.45
PIM2 Q9P1W9 1/20 0.45
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
BRD4 O60885 1/20 0.39
CREBBP Q92793 1/20 0.39
GAA P10253 1/20 0.38
EPHX2 P34913 1/20 0.37
ADCYAP1R1 P41586 1/20 0.37
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
MAPT P10636 1/20 0.35
CETP P11597 6/20 0.35

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
SCHEMBL8099305 0.88 GFER (0.49) GFERPIM1PIM2L3MBTL1SMN1; SMN2
SCHEMBL8090311 0.79 GFER (0.63) GFERL3MBTL1SMN1; SMN2GAA
SCHEMBL8098478 0.78 GFER (0.51) GFERALDH1A1L3MBTL1SMN1; SMN2GAA
SCHEMBL8090577 0.77 PIM1 (0.41) PIM1PIM2ALDH1A1BRD4CREBBP
SCHEMBL8097095 0.77 PIM1 (0.41) PIM1PIM2ALDH1A1BRD4CREBBP
SCHEMBL8098930 0.76 GFER (0.49) GFERALDH1A1L3MBTL1SMN1; SMN2GAA
SCHEMBL10677945 0.75 GFER (0.52) GFERALDH1A1L3MBTL1SMN1; SMN2GAA
SCHEMBL8099174 0.74 GFER (0.52) GFERALDH1A1L3MBTL1SMN1; SMN2GAA
SCHEMBL6686421 0.73 GFER (0.47) GFERALDH1A1L3MBTL1SMN1; SMN2GAA
SCHEMBL8098637 0.72 GFER (0.45) GFERALDH1A1L3MBTL1SMN1; SMN2GAA

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-0672038-B1 HERBICIDES ZENECA LTD (GB) 2000-01-19 EP disclosed
US-5856273-A CONTROLLING WEEDS ZENECA LIMITED (GB) 1999-01-05 US disclosed
EP-0672038-A1 HERBICIDES ZENECA LIMITED (GB) 1995-09-20 EP disclosed
WO-1994013652-A1 HERBICIDES ZENECA LIMITED (GB) 1994-06-23 WO disclosed