SCHEMBL8782155

SCHEMBL8782155

CC(=O)Nc1ccc(-c2cc(=O)c3c(N)ccc(F)c3o2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ NPY1R P25929 1/20 0.45
▸ NFKB2 Q00653 1/20 0.45
▸ RELA Q04206 1/20 0.45
▸ HDAC1 Q13547 8/20 0.41
▸ HDAC3 O15379 2/20 0.41
▸ HDAC2 Q92769 2/20 0.41
▸ NCOR2 Q9Y618 1/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ ESR1 P03372 1/20 0.41
▸ ESR2 Q92731 1/20 0.41
▸ CYP1B1 Q16678 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
SCHEMBL8782188 0.86 KMT2A (0.45) KMT2AMEN1SMN1; SMN2KDM4ENPC1
SCHEMBL8782447 0.82 NPC1 (0.52) KMT2AMEN1SMN1; SMN2KDM4ENPC1
SCHEMBL8783200 0.81 LCK (0.50) KMT2AKDM4EL3MBTL1ESR1ESR2
SCHEMBL10433074 0.80 ESR1 (0.66) KMT2AMEN1SMN1; SMN2KDM4ENPC1
SCHEMBL8782528 0.79 AR (0.38) KMT2AKDM4EL3MBTL1ESR1ESR2
SCHEMBL8782709 0.76 NPC1 (0.50) KMT2AMEN1SMN1; SMN2KDM4ENPC1
SCHEMBL8782389 0.73 CA1 (0.41) KMT2AKDM4ENPC1RAB9AHDAC1
SCHEMBL8782104 0.71 MEN1 (0.39) KMT2AMEN1SMN1; SMN2ALDH1A1HDAC1
SCHEMBL10432810 0.71 MEN1 (0.62) KMT2AMEN1SMN1; SMN2KDM4ENPC1
SCHEMBL8783453 0.70 NPC1 (0.47) KMT2AMEN1SMN1; SMN2KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0556720-B1 5-Aminoflavone derivatives KYOWA HAKKO KOGYO KK (JP) 1997-09-17 — — EP disclosed
US-5539112-A 5-aminoflavone derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1996-07-23 — — US disclosed
EP-0556720-A1 5-Aminoflavone derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1993-08-25 — — EP disclosed
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