SCHEMBL10795256

SCHEMBL10795256

O=C(CCCO)NNc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.66
GAA P10253 7/20 0.60
MAPT P10636 2/20 0.60
KDM4E B2RXH2 2/20 0.60
RAB9A P51151 1/20 0.60
SMN1; SMN2 Q16637 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
POLB P06746 1/20 0.53
BLM P54132 1/20 0.53
CTDSP1 Q9GZU7 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.51
CYP3A4 P08684 2/20 0.50
TSHR P16473 1/20 0.50
PTGS2 P35354 1/20 0.48
HDAC4 P56524 4/20 0.48
HDAC1 Q13547 4/20 0.48
HDAC7 Q8WUI4 4/20 0.48
HDAC11 Q96DB2 4/20 0.48

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
SCHEMBL30513891 0.90 ALOX5 (0.72) ALOX5GAAKDM4ESMN1; SMN2MEN1
SCHEMBL6633779 0.84 ALOX5 (0.80) ALOX5GAAKDM4ESMN1; SMN2MEN1
SCHEMBL17183577 0.84 ALOX5 (0.64) ALOX5GAAMAPTKDM4ESMN1; SMN2
SCHEMBL27627034 0.84 ALOX5 (0.64) ALOX5GAAMAPTKDM4ESMN1; SMN2
SCHEMBL17183532 0.82 ALOX5 (0.62) ALOX5GAAKDM4ESMN1; SMN2MEN1
SCHEMBL21596195 0.82 ALOX5 (0.62) ALOX5GAAKDM4ESMN1; SMN2MEN1
SCHEMBL21596219 0.82 ALOX5 (0.62) ALOX5GAAKDM4ESMN1; SMN2MEN1
SCHEMBL11133887 0.82 ALOX5 (0.77) ALOX5GAARAB9ASMN1; SMN2MEN1
SCHEMBL491040 0.81 ALOX5 (0.70) ALOX5GAAMAPTKDM4ESMN1; SMN2
SCHEMBL4594453 0.81 HDAC8 (0.68) MAPTKDM4ECYP3A4HDAC4HDAC1

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
US-4681828-A Method of chemical electrographic image amplification using chemically active toner particles EASTMAN KODAK COMPANY (US) 1987-07-21 US claimed
US-4681828-A Method of chemical electrographic image amplification using chemically active toner particles EASTMAN KODAK COMPANY (US) 1987-07-21 US disclosed