SCHEMBL28064109

SCHEMBL28064109

CCC1CCCCN1C(=O)OCC(C)C

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.58
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
NPC1 O15118 2/20 0.42
HPGD P15428 2/20 0.42
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 6/20 0.42
TSHR P16473 3/20 0.42
GAA P10253 1/20 0.42
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.41
POLB P06746 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SMN1; SMN2 Q16637 2/20 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
SCHEMBL4541731 0.88 RAB9A (0.58) RAB9AHTTHPGDKMT2AALDH1A1
SCHEMBL9978245 0.88 RAB9A (0.58) RAB9AL3MBTL1HTTHPGDKMT2A
SCHEMBL21057416 0.85 KDM4E (0.52) RAB9AATML3MBTL1MAPTNPC1
SCHEMBL9978311 0.85 RAB9A (0.56) RAB9AATML3MBTL1HTTNPC1
SCHEMBL1146693 0.85 RAB9A (0.56) RAB9AL3MBTL1HTTNPC1HPGD
SCHEMBL4576862 0.83 RAB9A (0.64) RAB9AL3MBTL1HTTHPGDKMT2A
SCHEMBL3360692 0.83 RAB9A (0.64) RAB9AL3MBTL1HTTHPGDKMT2A
SCHEMBL8800154 0.83 RAB9A (0.53) RAB9AL3MBTL1HTTHPGDKMT2A
SCHEMBL14898563 0.83 RAB9A (0.50) RAB9AMAPTHTTKMT2AMEN1
SCHEMBL14898564 0.83 RAB9A (0.50) RAB9AMAPTHTTKMT2AMEN1

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-104621099-B A kind of preparation method of mosquito repellent preserved flower Yuan Hong bio tech ltd, Ningbo (CN) 2016-05-04 CN claimed