SCHEMBL9869264

SCHEMBL9869264

CCCCCCCCN1CC(CO)CC1=O

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.54
GBA1 P04062 5/20 0.48
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 1/20 0.43
PRKCD Q05655 4/20 0.41
MEN1 O00255 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
GBA2 Q9HCG7 6/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL9368683 0.98 BRD4 (0.56) BRD4GBA1L3MBTL1ALDH1A1PRKCD
SCHEMBL11623610 0.93 BRD4 (0.58) BRD4GBA1L3MBTL1ALDH1A1MEN1
SCHEMBL9368747 0.82 GBA1 (0.42) BRD4GBA1L3MBTL1ALDH1A1MEN1
SCHEMBL8076306 0.76 POLB (0.56) GBA1L3MBTL1ALDH1A1MEN1CYP2C19
SCHEMBL15082405 0.76 POLB (0.56) GBA1L3MBTL1ALDH1A1MEN1CYP2C19
SCHEMBL8084202 0.76 POLB (0.56) GBA1L3MBTL1ALDH1A1MEN1CYP2C19
SCHEMBL2890516 0.76 POLB (0.56) GBA1L3MBTL1ALDH1A1MEN1CYP2C19
SCHEMBL119623 0.76 POLB (0.56) GBA1L3MBTL1ALDH1A1MEN1CYP2C19
SCHEMBL8084223 0.76 POLB (0.56) GBA1L3MBTL1ALDH1A1MEN1CYP2C19
SCHEMBL14477954 0.76 POLB (0.56) GBA1L3MBTL1ALDH1A1MEN1CYP2C19

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-4985521-A COPOLYMERS, COMPLEXES WITH WATER INSOLUBLE MOLECULES GAF CHEMICALS CORPORATION (US) 1991-01-15 US disclosed
US-4946967-A CHEMICAL INTERMEDIATES FOR HIGH MOLECULAR WEIGHT ACYCLIC ESTER OR AMIDE GAF CHEMICALS CORPORATION (US) 1990-08-07 US disclosed