SCHEMBL8030828

SCHEMBL8030828

Fc1cc(Cl)[c]cc1-c1ncc(C(F)(F)F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
KDM4E B2RXH2 2/20 0.39
POLB P06746 1/20 0.39
PKM P14618 2/20 0.38
LMNA P02545 1/20 0.37
NPC1 O15118 5/20 0.36
RAB9A P51151 5/20 0.36
MAPK1 P28482 1/20 0.36
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
TRPA1 O75762 1/20 0.34
PLAU P00749 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
HSD11B1 P28845 1/20 0.33
MEN1 O00255 1/20 0.33
STAT3 P40763 1/20 0.33
STAT1 P42224 1/20 0.33
CASP3 P42574 1/20 0.33
KMT2A Q03164 1/20 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
SCHEMBL7680164 0.73 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2KDM4EPOLBPKM
SCHEMBL7672722 0.70 KDM4E (0.40) ALDH1A1SMN1; SMN2KDM4EPOLBPKM
SCHEMBL8032396 0.70 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2KDM4EPOLBPKM
SCHEMBL27303069 0.69 MEN1 (0.36) MEN1KMT2A
SCHEMBL4371563 0.68 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2KDM4EPOLBPKM
SCHEMBL30062543 0.68 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2KDM4EPOLBPKM
SCHEMBL29055192 0.68 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2KDM4EPOLBPKM
SCHEMBL6019107 0.67 CYP1A2 (0.45) ALDH1A1SMN1; SMN2KDM4EPOLBPKM
SCHEMBL7674890 0.66 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2KDM4EPOLBPKM
SCHEMBL20267065 0.65 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2KDM4EPOLBPKM

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
EP-0984933-A1 SUBSTITUTED 2-PHENYL PYRIDINES, THEIR MANUFACTURE AND USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-03-15 EP disclosed
WO-1998054137-A1 SUBSTITUTED 2-PHENYL PYRIDINES, THEIR MANUFACTURE AND USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-12-03 WO disclosed