SCHEMBL30901429

SCHEMBL30901429

O=[N+]([O-])c1cc(F)c(F)c2cccnc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.65
ALDH1A1 P00352 10/20 0.65
MEN1 O00255 8/20 0.65
KMT2A Q03164 8/20 0.65
KDM4E B2RXH2 7/20 0.65
TDP1 Q9NUW8 6/20 0.65
L3MBTL1 Q9Y468 5/20 0.65
LMNA P02545 4/20 0.65
PKM P14618 3/20 0.65
IDO1 P14902 2/20 0.65
TDO2 P48775 2/20 0.65
CASP6 P55212 2/20 0.65
POLB P06746 2/20 0.65
THRB P10828 1/20 0.65
RECQL P46063 1/20 0.65
BLM P54132 1/20 0.65
CTSB P07858 2/20 0.55
GAA P10253 2/20 0.55
SMN1; SMN2 Q16637 5/20 0.51
HSP90AA1 P07900 3/20 0.51

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
SCHEMBL11973087 1.00 MAPT (0.65) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL11972798 0.85 MAPT (0.62) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL8724077 0.81 MAPT (0.67) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL25253980 0.79 MAPT (0.79) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL27190082 0.79 MAPT (1.00) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL18496985 0.79 MAPT (0.62) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL2555260 0.78 MAPT (0.67) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL7960630 0.76 MAPT (0.79) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL10510901 0.76 SLC40A1 (0.51) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL24716165 0.76 MAPT (0.65) MAPTALDH1A1MEN1KMT2AKDM4E

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-117820225-A 3- (8-amino-5, 6-difluoro-4-quinolyl) -2-cyanoacrylate, and preparation method and application thereof 湘潭大学 2024-04-05 CN disclosed