SCHEMBL28471306

SCHEMBL28471306

O=C(F)c1cc2ccccc2[nH]1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 5/20 0.71
KDM4E B2RXH2 4/20 0.69
MAPT P10636 1/20 0.69
DAO P14920 1/20 0.69
HPGD P15428 1/20 0.69
SRD5A2 P31213 1/20 0.69
HSD17B10 Q99714 1/20 0.69
ALDH1A1 P00352 2/20 0.61
GAA P10253 1/20 0.61
MAPK1 P28482 1/20 0.61
PDGFRB P09619 3/20 0.57
PDGFRA P16234 3/20 0.57
LMNA P02545 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
IDO1 P14902 1/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
TP53 P04637 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
HRH4 Q9H3N8 2/20 0.53

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
SCHEMBL31277139 0.83 FLT3 (0.77) FLT3KDM4EMAPTDAOHPGD
SCHEMBL5639746 0.83 FLT3 (0.64) FLT3KDM4EMAPTDAOHPGD
SCHEMBL370573 0.83 FLT3 (1.00) FLT3KDM4EMAPTDAOHPGD
SCHEMBL31060426 0.83 FLT3 (1.00) FLT3KDM4EMAPTDAOHPGD
SCHEMBL1151122 0.82 FLT3 (0.74) FLT3KDM4EMAPTDAOHPGD
Methane SCHEMBL22343918 0.82 FLT3 (0.96) FLT3KDM4EMAPTDAOHPGD
Indole-2-Carboxylic Acid SCHEMBL29395165 0.82 KDM4E (1.00) FLT3KDM4EMAPTDAOHPGD
Indole-2-Carboxylic Acid SCHEMBL1935 0.82 KDM4E (1.00) FLT3KDM4EMAPTDAOHPGD
SCHEMBL6923977 0.81 IDO1 (0.68) FLT3KDM4EMAPTDAOHPGD
SCHEMBL2721054 0.80 FLT3 (0.71) FLT3KDM4EMAPTDAOHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111629592-A Liquid fertilizer dispersion composition and method thereof 拜耳作物科学有限合伙公司 2020-09-04 CN disclosed