SCHEMBL12640291

SCHEMBL12640291

CC(C)c1ccc(C(=O)CN2C(=O)CCC2=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
USP5 P45974 1/20 0.50
TSHR P16473 1/20 0.47
ALDH1A1 P00352 4/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
LMNA P02545 3/20 0.44
HPGD P15428 2/20 0.43
TP53 P04637 2/20 0.43
POLB P06746 4/20 0.43
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
MPI P34949 1/20 0.42
NSD2 O96028 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL18825263 0.81 RAB9A (0.66) RAB9ASMN1; SMN2TSHRALDH1A1MEN1
SCHEMBL18825265 0.81 SMN1; SMN2 (0.66) RAB9ASMN1; SMN2TSHRALDH1A1MEN1
SCHEMBL18825267 0.78 SMN1; SMN2 (0.81) RAB9ASMN1; SMN2TSHRALDH1A1MEN1
SCHEMBL18825272 0.77 NPC1 (0.64) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL5846697 0.75 SMN1; SMN2 (0.77) RAB9ASMN1; SMN2TSHRALDH1A1KMT2A
SCHEMBL13006683 0.74 USP5 (0.50) RAB9ASMN1; SMN2USP5ALDH1A1MEN1
SCHEMBL18825258 0.73 SMN1; SMN2 (0.63) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL14924022 0.73 MEN1 (0.69) SMN1; SMN2USP5ALDH1A1MEN1KMT2A
SCHEMBL18825274 0.73 RAB9A (0.59) RAB9ASMN1; SMN2POLB
SCHEMBL26744028 0.73 RAB9A (0.59) RAB9ASMN1; SMN2TSHRALDH1A1MEN1

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-7935782-B2 Multifunctional degradable nanoparticles with control over size and functionalities VANDERBILT UNIVERSITY (US) 2011-05-03 US disclosed
US-20090306335-A1 MULTIFUNCTIONAL DEGRADABLE NANOPARTICLES WITH CONTROL OVER SIZE AND FUNCTIONALITIES NATIONAL SCIENCE FOUNDATION 2009-12-10 US disclosed