SCHEMBL8935272

SCHEMBL8935272

CC(N)(Cc1ccc(OCc2ccoc2)cc1)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.47
PARP10 Q53GL7 5/20 0.42
BLM P54132 1/20 0.41
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
NR4A2 P43354 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
MAOB P27338 2/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
ALOX5 P09917 1/20 0.38
PPARG P37231 1/20 0.37
CETP P11597 1/20 0.37
PLK1 P53350 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
SCHEMBL28904310 0.81 NPC1 (0.56) PARP10MAOBNPC1RAB9A
SCHEMBL27309675 0.81 PARP10 (0.57) PARP10NR4A2MAOBRAB9AALOX5
SCHEMBL28510234 0.80 MAOB (0.57) PARP10NR4A2MAOBNPC1RAB9A
Hydrochloric Acid SCHEMBL27353104 0.80 PARP10 (0.56) PARP10NR4A2MAOBRAB9AALOX5
SCHEMBL28500733 0.80 MAOB (0.61) PARP10NR4A2MAOB
SCHEMBL27311683 0.80 PPARG (0.53) PARP10BLMNR4A2MAOBALOX5
SCHEMBL8935338 0.79 PARP10 (0.48) PARP10BLMNR4A2RXRARXRB
SCHEMBL8935371 0.79 GAA (0.56) ACACBBLMSLC1A3SLC1A2SLC1A1
SCHEMBL8935384 0.78 PARP10 (0.43) PARP10BLMSLC1A3SLC1A2SLC1A1
SCHEMBL28503302 0.77 PARP10 (0.45) PARP10BLMNR4A2RXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5502079-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS FARMITALIA CARLO ERBA S.R.L. (IT) 1996-03-26 US disclosed