SCHEMBL9377017

SCHEMBL9377017

CC(C)(C)c1cc(CCC(=O)NN)c(O)c(-n2nc3ccc(Cl)cc3n2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
ALDH1A1 P00352 4/20 0.34
RXFP1 Q9HBX9 1/20 0.34
MAPT P10636 3/20 0.33
KDM4E B2RXH2 3/20 0.33
ADAM17 P78536 2/20 0.33
TP53 P04637 2/20 0.33
POLB P06746 2/20 0.33
PKM P14618 2/20 0.33
GFER P55789 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL9376139 0.89 GAA (0.43) GAAALDH1A1MAPTKDM4EADAM17
SCHEMBL9376191 0.87 NPC1 (0.44) GAAALDH1A1RXFP1MAPTKDM4E
SCHEMBL19119905 0.83 NPC1 (0.39) ALDH1A1RXFP1MAPTKDM4ETP53
SCHEMBL9501153 0.82 GAA (0.58) GAAALDH1A1RXFP1MAPTTP53
SCHEMBL9408764 0.82 NPC1 (0.38) RXFP1MAPTKDM4EPOLBSMN1; SMN2
SCHEMBL20592414 0.82 NPC1 (0.39) RXFP1MAPTKDM4ETP53POLB
SCHEMBL9408770 0.82 EPHX2 (0.36) RXFP1MAPTTP53SMN1; SMN2NPC1
SCHEMBL28641188 0.81 NPC1 (0.39) RXFP1MAPTKDM4ETP53POLB
SCHEMBL9408789 0.80 EPHX2 (0.34) RXFP1MAPTTP53SMN1; SMN2NPC1
SCHEMBL9501982 0.79 GAA (0.41) GAAALDH1A1RXFP1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0308886-B1 Dianhydride coupled polymer stabilizers ATOCHEM NORTH AMERICA (US) 1994-11-23 EP disclosed
US-4874803-A HEAT AND OXIDATION RESISTANCE; PHOTOSTABILITY PENNWALT CORPORATION (US) 1989-10-17 US disclosed
EP-0308886-A2 Dianhydride coupled polymer stabilizers ATOCHEM NORTH AMERICA, INC. (US) 1989-03-29 EP disclosed