SCHEMBL28282168

SCHEMBL28282168

CC(Cc1ccccc1)C1CCCNC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.42
CPB2 Q96IY4 1/20 0.42
KMT2A Q03164 1/20 0.40
SIGMAR1 Q99720 2/20 0.40
EED O75530 1/20 0.39
SLC6A2 P23975 3/20 0.38
MAOB P27338 2/20 0.38
SLC6A4 P31645 2/20 0.38
KDM1A O60341 1/20 0.38
MAOA P21397 2/20 0.38
TAAR1 Q96RJ0 2/20 0.38
SLC6A3 Q01959 1/20 0.38
CYP2A6 P11509 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
NISCH Q9Y2I1 1/20 0.38

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
SCHEMBL27463593 0.81 CPN1 (0.42) CPN1CPB2KMT2ASLC6A2MAOB
SCHEMBL9281404 0.81 CHRM2 (0.39) CPN1CPB2KMT2AEEDSLC6A2
SCHEMBL22850604 0.80 GBA1 (0.50) SIGMAR1SLC6A2MAOBSLC6A4MAOA
SCHEMBL8806240 0.80 SIGMAR1 (0.46) SIGMAR1SLC6A2SLC6A4MAOATAAR1
SCHEMBL5191726 0.77 POLB (0.41) CPN1CPB2SLC6A2MAOBSLC6A4
SCHEMBL19121854 0.76 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3
SCHEMBL7649264 0.75 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL1623808 0.75 CTSC (0.44) CPN1CPB2KMT2A
Hydrochloric Acid SCHEMBL1623813 0.75 CTSC (0.44) CPN1CPB2KMT2A
SCHEMBL2691265 0.74 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3

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
CN-109354331-A A kind of method of biologic packing material anaerobic technique processing industrial wastewater 辽宁中舟得水环保科技有限公司 2019-02-19 CN claimed
CN-109354331-A A kind of method of biologic packing material anaerobic technique processing industrial wastewater 辽宁中舟得水环保科技有限公司 2019-02-19 CN disclosed