SCHEMBL28210909

SCHEMBL28210909

CCC(CC)C(=O)c1cncs1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.38
KMT2A Q03164 5/20 0.38
ACACB O00763 3/20 0.38
KIF11 P52732 1/20 0.36
PKM P14618 2/20 0.33
ALDH1A1 P00352 4/20 0.32
MEN1 O00255 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
SLC6A3 Q01959 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
ACP1 P24666 1/20 0.30

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
SCHEMBL25139581 0.79 CA2 (0.42) PIK3CDHDAC8
SCHEMBL10044969 0.79 PIK3CD (0.44) PIK3CDKMT2AACACBKIF11HDAC8
SCHEMBL5608437 0.75 KMT2A (0.41) PIK3CDKMT2AACACBKIF11HDAC8
SCHEMBL24568381 0.73 ACACB (0.55) KMT2AACACBKIF11PKMALDH1A1
SCHEMBL299024 0.71
SCHEMBL5752803 0.71 KMT2A (0.47) PIK3CDKMT2AACACBKIF11PKM
SCHEMBL27954410 0.70 RPS6KA3 (0.37) KMT2APKMALDH1A1KDM4EGAA
SCHEMBL23959384 0.70 KIF11 (0.50) PIK3CDKMT2AACACBKIF11ALDH1A1
SCHEMBL290564 0.70 CDC7 (0.49) KMT2AACACBPKMALDH1A1MEN1
SCHEMBL23959147 0.69 KIF11 (0.41) PIK3CDKMT2AACACBKIF11ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105981721-B A kind of bactericidal composition for preventing and treating soil biography or seed-borne disease 中化农化有限公司 2019-01-22 CN disclosed
CN-105613530-B A kind of disinsection prophylaxis composition pesticide containing four chlorantraniliproles and its application 中化农化有限公司 2018-04-27 CN disclosed
CN-105613530-A Insect-killing disease-preventing pesticide composition containing Silvchongxian'an and application thereof SINOCHEM AGRO CO LTD 2016-06-01 CN disclosed
CN-104522005-A Pesticide composition containing thiobenzamide GUANGXI YISHENGYUAN ECOLOGICAL AGRICULTURE CO LTD 2015-04-22 CN disclosed
CN-101796955-B Composite bactericidal composite and applications thereof QINGDAO STAR CORPSCIENCE CO LTD 2013-04-17 CN disclosed
CN-101796955-A Composite bactericidal composite and applications thereof CHENGDU STAR CORP SCIENCE CO LTD 2010-08-11 CN disclosed