SCHEMBL9788477

SCHEMBL9788477

CCOC(=O)c1cccc(Oc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
KMT2A Q03164 5/20 0.47
LMNA P02545 4/20 0.47
MEN1 O00255 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
POLB P06746 2/20 0.47
SERPINE1 P05121 1/20 0.45
ICAM1 P05362 1/20 0.42
SELE P16581 1/20 0.42
KDM4E B2RXH2 1/20 0.42
EPAS1 Q99814 1/20 0.42
MAPT P10636 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
TTR P02766 1/20 0.42
PPOX P50336 1/20 0.42
USP10 Q14694 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.41
HSP90AA1 P07900 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GFER P55789 1/20 0.41

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
SCHEMBL9788478 0.88 ALDH1A1 (0.45) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL9788491 0.86 SERPINE1 (0.56) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL9788483 0.83 KIF11 (0.48) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL2970392 0.81 KMT2A (0.50) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL9788470 0.81 ELANE (0.48) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL9788472 0.80 SMN1; SMN2 (0.47) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL2970880 0.79 SMN1; SMN2 (0.49) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL9788475 0.79 KIF11 (0.45) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL28165935 0.79 MAPT (0.51) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL9788482 0.79 SMN1; SMN2 (0.51) ALDH1A1KMT2ALMNAMEN1SMN1; SMN2

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
US-5026895-A For cultivated plants BUDAPESTI VEGYIMUVEK (HU) 1991-06-25 US disclosed