SCHEMBL6182290

SCHEMBL6182290

CCOC(=O)C(C)=Cc1cc(-c2ncc(C(F)(F)F)cc2Cl)ccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.55
HPGD P15428 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.48
LMNA P02545 1/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
NPSR1 Q6W5P4 1/20 0.44
RECQL P46063 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPT P10636 2/20 0.43
POLB P06746 3/20 0.41
GAA P10253 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPC1 O15118 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL6182286 1.00 ALDH1A1 (0.55) ALDH1A1HPGDL3MBTL1LMNAMEN1
SCHEMBL6176807 0.82 ALDH1A1 (0.50) ALDH1A1HPGDL3MBTL1LMNAMEN1
SCHEMBL6176814 0.82 ALDH1A1 (0.50) ALDH1A1HPGDL3MBTL1LMNAMEN1
SCHEMBL6177066 0.81 MAPK1 (0.46) ALDH1A1HPGDL3MBTL1LMNAMEN1
SCHEMBL6177069 0.81 MAPK1 (0.46) ALDH1A1HPGDL3MBTL1LMNAMEN1
SCHEMBL7765151 0.80 ALDH1A1 (0.44) ALDH1A1HPGDL3MBTL1LMNAMEN1
SCHEMBL27438241 0.78 L3MBTL1 (0.51) ALDH1A1HPGDL3MBTL1MEN1KMT2A
SCHEMBL6177032 0.77 L3MBTL1 (0.46) ALDH1A1HPGDL3MBTL1LMNAMEN1
SCHEMBL6178717 0.77 ALDH1A1 (0.45) ALDH1A1HPGDL3MBTL1MEN1KMT2A
SCHEMBL6177462 0.76 ALDH1A1 (0.54) ALDH1A1HPGDLMNAMEN1KMT2A

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-0708756-B1 SUBSTITUTED 2-PHENYLPYRIDINES WITH HERBICIDAL ACTION BASF AG (DE) 2005-06-01 EP disclosed
US-5783522-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-07-21 US disclosed
EP-0708756-A1 SUBSTITUTED 2-PHENYLPYRIDINES WITH HERBICIDAL ACTION BASF AKTIENGESELLSCHAFT (DE) 1996-05-01 EP disclosed
WO-1995002580-A2 SUBSTITUTED 2-PHENYLPYRIDINES WITH HERBICIDAL ACTION BASF AKTIENGESELLSCHAFT (DE) 1995-01-26 WO disclosed