SCHEMBL9575134

SCHEMBL9575134

CCC(C)(C)c1cc(CCCNC(=O)C(=O)NN)cc(C(C)(C)CC)c1O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.50
KMT2A Q03164 3/20 0.43
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
ESRRG P62508 1/20 0.34
NR5A2 O00482 1/20 0.34
NR5A1 Q13285 1/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KDR P35968 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
GSK3B P49841 2/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL9575245 0.88 GAA (0.64) GAAKMT2ALMNAESRRGNR5A2
SCHEMBL9575255 0.84 GAA (0.59) GAAKMT2ALMNANR5A2NR5A1
SCHEMBL9575286 0.84 GAA (0.43) GAAKMT2ALMNARAB9AMEN1
SCHEMBL11507342 0.81 GAA (0.72) GAAKMT2ALMNAESRRGNR5A2
SCHEMBL9575147 0.80 GAA (0.62) GAAKMT2ALMNAMEN1MAPT
SCHEMBL8336553 0.77 GAA (0.76) GAAKMT2ASMN1; SMN2LMNAMEN1
SCHEMBL9575276 0.75 GAA (0.45) GAAKMT2APOLBLMNAMEN1
SCHEMBL8340801 0.74 GAA (0.40) GAAKMT2ALMNANPC1RAB9A
SCHEMBL2069834 0.74 MAPK1 (0.48) GAAKMT2ALMNANPC1RAB9A
SCHEMBL13507866 0.73 KMT2A (0.64) GAAKMT2ASMN1; SMN2MEN1MAPT

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-0303280-B1 PHENOLIC ANTIOXIDANT HYDRAZIDES ATOCHEM NORTH AMERICA, INC. (US) 1993-03-24 EP disclosed
EP-0303280-A2 Phenolic antioxidant hydrazides ATOCHEM NORTH AMERICA, INC. (US) 1989-02-15 EP disclosed
US-4801749-A Phenolic antioxidant hydrazides PENNWALT CORPORATION (US) 1989-01-31 US disclosed