SCHEMBL30443271

SCHEMBL30443271

CCC(=O)N(CCc1ccccc1)C(=O)CC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
ALOX5 P09917 5/20 0.50
OPRM1 P35372 3/20 0.50
TAAR1 Q96RJ0 1/20 0.50
AOC3 Q16853 2/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.46
MLYCD O95822 1/20 0.45
KEAP1 Q14145 1/20 0.45
CHRM2 P08172 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
CHRM1 P11229 1/20 0.44
DRD1 P21728 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44

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
SCHEMBL14191750 0.87 L3MBTL1 (0.49) KMT2AMEN1NPC1RAB9ATDP1
SCHEMBL7330149 0.86 AOC3 (0.42) KMT2AMEN1NPC1RAB9ATDP1
SCHEMBL7321367 0.85 KMT2A (0.41) KMT2AMEN1NPC1RAB9ATDP1
SCHEMBL4144964 0.83 LTB4R (0.56) KMT2AMEN1NPC1RAB9ATDP1
SCHEMBL28255755 0.81 KMT2A (0.50) KMT2AMEN1NPC1RAB9ATDP1
SCHEMBL29176461 0.80 OPRM1 (0.59) KMT2AMEN1NPC1RAB9ATDP1
SCHEMBL4333356 0.79 KMT2A (0.55) KMT2AMEN1NPC1RAB9ATDP1
SCHEMBL28398036 0.78 KMT2A (0.46) KMT2AMEN1NPC1RAB9ATDP1
SCHEMBL20220512 0.77 LTB4R (0.45) KMT2AALOX5OPRM1MLYCD
SCHEMBL14219241 0.77 ALDH1A1 (0.56) KMT2AMEN1NPC1RAB9ATDP1

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
CN-116262708-A Method for preparing imide derivative 中国科学院大连化学物理研究所 2023-06-16 CN disclosed