SCHEMBL6861158

SCHEMBL6861158

Fc1cccc(F)c1C1=NN(c2ccc(Br)cc2)CCO1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.35
ALDH1A1 P00352 18/20 0.34
MAPT P10636 18/20 0.34
HPGD P15428 17/20 0.34
L3MBTL1 Q9Y468 14/20 0.34
MEN1 O00255 13/20 0.34
KMT2A Q03164 13/20 0.34
GLA P06280 7/20 0.34
TDP1 Q9NUW8 4/20 0.34
RECQL P46063 3/20 0.34
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 2/20 0.33
ATM Q13315 2/20 0.33

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
SCHEMBL6862184 0.78 SCN5A (0.38) DGAT1
SCHEMBL6864671 0.74 CYP2A13 (0.33) DGAT1ALDH1A1L3MBTL1KMT2ALMNA
SCHEMBL8789519 0.67 TAAR1 (0.40) ALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL5737404 0.64 TAAR1 (0.54) ALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL7739076 0.63 HDAC8 (0.36) DGAT1L3MBTL1LMNASMN1; SMN2
SCHEMBL28232291 0.63 NPSR1 (0.40) ALDH1A1MAPTHPGDL3MBTL1MEN1
SCHEMBL6862404 0.62 KCNH2 (0.37) DGAT1ALDH1A1MAPTMEN1KMT2A
SCHEMBL8093252 0.62 ABHD16A (0.40) ALDH1A1MAPTMEN1KMT2AGLA
SCHEMBL8864159 0.60 PDE3B (0.34) DGAT1
SCHEMBL2523479 0.60 TTR (0.52) ALDH1A1MAPTL3MBTL1MEN1KMT2A

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-0797574-B1 1,3,4-OXADIAZINE DERIVATIVES HAVING A PESTICIDE EFFECT BAYER CROPSCIENCE AG (DE) 2004-03-17 EP disclosed
US-5883091-A 1,3,4-oxadiazine derivatives having a pesticide effect BAYER AKTIENGESELLSCHAFT (DE) 1999-03-16 US disclosed
EP-0797574-A1 1,3,4-OXADIAZINE DERIVATIVES HAVING A PESTICIDE EFFECT BAYER AG (DE) 1997-10-01 EP disclosed
WO-1996018624-A1 1,3,4-OXADIAZINE DERIVATIVES HAVING A PESTICIDE EFFECT BAYER AKTIENGESELLSCHAFT (DE) 1996-06-20 WO disclosed