SCHEMBL11064771

SCHEMBL11064771

O=C(NCCO)C1CC2C=CC1C2

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.61
LMNA P02545 1/20 0.61
EPHX2 P34913 3/20 0.44
ESR1 P03372 1/20 0.42
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 2/20 0.41
THRB P10828 1/20 0.41
POLB P06746 4/20 0.37
APEX1 P27695 1/20 0.37
RECQL P46063 1/20 0.37
BLM P54132 1/20 0.37
ESR2 Q92731 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL11064769 1.00 KDM4E (0.61) KDM4ELMNAEPHX2ESR1RAB9A
SCHEMBL6137154 0.86 KDM4E (0.65) KDM4ELMNAEPHX2ESR1RAB9A
SCHEMBL9924679 0.85 KDM4E (0.59) KDM4ELMNAEPHX2ESR1RAB9A
SCHEMBL14392991 0.85 KDM4E (0.59) KDM4ELMNAEPHX2ESR1RAB9A
SCHEMBL10124090 0.85 KDM4E (0.59) KDM4ELMNAEPHX2ESR1RAB9A
SCHEMBL5395258 0.82 KDM4E (0.56) KDM4ELMNAEPHX2ESR1RAB9A
SCHEMBL14400824 0.82 LMNA (0.51) KDM4ELMNAEPHX2ESR1RAB9A
SCHEMBL10048448 0.82 LMNA (0.51) KDM4ELMNAEPHX2ESR1RAB9A
SCHEMBL25361995 0.81 KDM4E (0.54) KDM4ELMNAEPHX2ESR1RAB9A
SCHEMBL9924686 0.81 KDM4E (0.54) KDM4ELMNAEPHX2ESR1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4438278-A CROSSLINKABLE MONOMERS EASTMAN KODAK COMPANY (US) 1984-03-20 US disclosed
US-4346231-A Polymerizable ethylenically unsaturated amide compounds PONTICELLO IGNAZIO S 1982-08-24 US disclosed
US-4247673-A COLOR COUPLERS, PHOTOGRAPHY EASTMAN KODAK COMPANY (US) 1981-01-27 US disclosed
US-4215195-A CROSSLINKABLE, POLYMERIC COLOR COUPLERS, GELATIN EXTENDERS, BINDERS EASTMAN KODAK COMPANY (US) 1980-07-29 US disclosed