SCHEMBL28616697

SCHEMBL28616697

CC(C)COCc1ccc(O)c2ncccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 1.00
L3MBTL1 Q9Y468 8/20 1.00
NPC1 O15118 5/20 1.00
HTT P42858 4/20 1.00
RAB9A P51151 4/20 1.00
MAPT P10636 3/20 1.00
BRD4 O60885 2/20 0.69
MITF O75030 1/20 0.69
ALOX12 P18054 2/20 0.68
NPSR1 Q6W5P4 1/20 0.68
LMNA P02545 3/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
ALDH1A1 P00352 2/20 0.64
TP53 P04637 1/20 0.64
POLB P06746 1/20 0.64
TSHR P16473 1/20 0.64
MAPK1 P28482 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
GAA P10253 1/20 0.59
PAX8 Q06710 1/20 0.52

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
Hydrochloric Acid SCHEMBL28624698 0.99 KDM4E (0.97) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL14768490 0.84 KDM4E (0.79) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL30345672 0.84 KDM4E (0.79) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL28862876 0.83 KDM4E (0.77) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL17799263 0.83 KDM4E (0.71) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL28976997 0.83 KDM4E (0.77) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL4468901 0.81 KDM4E (1.00) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL8030826 0.80 KDM4E (0.67) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL1143693 0.80 KDM4E (0.85) KDM4EL3MBTL1NPC1HTTRAB9A
SCHEMBL17223772 0.79 KDM4E (1.00) KDM4EL3MBTL1NPC1HTTRAB9A

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-113087665-B Compound and pharmaceutical composition for promoting cell movement, and preparation and application thereof 广州市朝利良生物科技有限公司 2022-02-08 CN claimed
CN-113087665-A Compound and pharmaceutical composition for promoting cell movement, and preparation and application thereof 广州市朝利良生物科技有限公司 2021-07-09 CN claimed
CN-113087665-B Compound and pharmaceutical composition for promoting cell movement, and preparation and application thereof 广州市朝利良生物科技有限公司 2022-02-08 CN disclosed
CN-113087665-B Compound and pharmaceutical composition for promoting cell movement, and preparation and application thereof 广州市朝利良生物科技有限公司 2022-02-08 CN disclosed
CN-113087665-A Compound and pharmaceutical composition for promoting cell movement, and preparation and application thereof 广州市朝利良生物科技有限公司 2021-07-09 CN disclosed
CN-113087665-A Compound and pharmaceutical composition for promoting cell movement, and preparation and application thereof 广州市朝利良生物科技有限公司 2021-07-09 CN disclosed