SCHEMBL8693787

SCHEMBL8693787

CCC(=O)CC(=O)O.NC(=O)CC(N)=O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
LDHA P00338 1/20 0.38
SRR Q9GZT4 1/20 0.38
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
KDM4E B2RXH2 1/20 0.31
KDM6B O15054 1/20 0.31
KDM5C P41229 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
PHF8 Q9UPP1 1/20 0.31
KDM2A Q9Y2K7 1/20 0.31
GLRA1 P23415 1/20 0.30
SLC6A9 P48067 1/20 0.30
OR51E2 Q9H255 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL1142940 0.87 TDP1 (0.50) FFAR3TDP1LDHASRRHDAC3
SCHEMBL24358 0.87
SCHEMBL1170592 0.84 FFAR3 (0.47) FFAR3TDP1LDHASRRHDAC3
SCHEMBL333060 0.84 FFAR3 (0.47) FFAR3TDP1LDHASRRHDAC3
SCHEMBL9125434 0.84 FFAR3 (0.47) FFAR3TDP1LDHASRRHDAC3
SCHEMBL527721 0.84
Ammonia Solution, Strong SCHEMBL14935458 0.84
SCHEMBL10956057 0.84
SCHEMBL2418314 0.84
SCHEMBL17106050 0.84

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-5763523-A ACRYLAMIDE COPOLYMERS, FLOCCULATION AND ALDEHYDE SCAVENGERS CYTEC TECHNOLOGY CORP. (US) 1998-06-09 US disclosed
US-5763530-A Stable emulsion blends and methods for their use CYTEC TECHNOLOGY CORP. (US) 1998-06-09 US disclosed