SCHEMBL8376199

SCHEMBL8376199

Fc1cccc(F)c1C(Cl)=NN=C(Cl)c1ccccc1Br

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
ALOX15 P16050 1/20 0.39
NPC1 O15118 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAOB P27338 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
CES2 O00748 3/20 0.34
CES1 P23141 3/20 0.34
GAA P10253 2/20 0.34
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
LMNA P02545 4/20 0.33
HTT P42858 2/20 0.33
TP53 P04637 1/20 0.33
BCHE P06276 1/20 0.32
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL8376198 1.00 ALDH1A1 (0.39) ALDH1A1ALOX15NPC1SMN1; SMN2MAOB
SCHEMBL8374758 0.82 CES2 (0.48) ALDH1A1ALOX15CES2CES1GAA
SCHEMBL9233541 0.78 CES2 (0.41) ALDH1A1ALOX15NPC1SMN1; SMN2HPGD
SCHEMBL9233543 0.78 CES2 (0.41) ALDH1A1ALOX15NPC1SMN1; SMN2HPGD
SCHEMBL18938482 0.72 MAOB (0.38) ALDH1A1ALOX15NPC1SMN1; SMN2MAOB
SCHEMBL23731404 0.72 CES2 (0.39) ALDH1A1ALOX15CES2CES1GAA
SCHEMBL19900564 0.72 CES2 (0.39) ALDH1A1ALOX15CES2CES1GAA
SCHEMBL18938855 0.71 MEN1 (0.41) ALDH1A1NPC1SMN1; SMN2HPGDRAB9A
SCHEMBL899003 0.70 MEN1 (0.41) ALDH1A1NPC1SMN1; SMN2HPGDRAB9A
SCHEMBL899002 0.70 MEN1 (0.41) ALDH1A1NPC1SMN1; SMN2HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635499-B1 Novel acaricidally active tetrazine derivatives CHINOIN GYOGYSZER ES VEGYESZET (HU) 1999-03-03 EP disclosed
US-5455237-A Larvicides, ovicides CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1995-10-03 US disclosed
EP-0635499-A2 Novel acaricidally active tetrazine derivatives CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1995-01-25 EP disclosed