SCHEMBL5677233

SCHEMBL5677233

CC1(O)C=CC(C(=O)c2ccccc2)=CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
ATM Q13315 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SRD5A2 P31213 1/20 0.36
HPGDS O60760 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
MAPK1 P28482 1/20 0.35
EZH2 Q15910 1/20 0.35
PTGES O14684 1/20 0.34
ALOX5 P09917 1/20 0.34
AKR1C3 P42330 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ELANE P08246 2/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL2470211 0.85 ALDH1A1 (0.42) ALDH1A1HPGDRAB9ANPC1L3MBTL1
SCHEMBL136599 0.83 ALDH1A1 (0.43) ALDH1A1HPGDRAB9ANPC1L3MBTL1
SCHEMBL7420070 0.83 ALDH1A1 (0.39) ALDH1A1HPGDRAB9ANPC1L3MBTL1
SCHEMBL27661013 0.83 ALDH1A1 (0.39) ALDH1A1HPGDRAB9ANPC1L3MBTL1
SCHEMBL28642593 0.83 ALDH1A1 (0.39) ALDH1A1HPGDRAB9ANPC1L3MBTL1
SCHEMBL28643160 0.83 ALDH1A1 (0.39) ALDH1A1HPGDRAB9ANPC1L3MBTL1
SCHEMBL28271865 0.83 ALDH1A1 (0.39) ALDH1A1HPGDRAB9ANPC1L3MBTL1
Hydrochloric Acid SCHEMBL8844133 0.81 ALDH1A1 (0.38) ALDH1A1HPGDRAB9ANPC1L3MBTL1
SCHEMBL27911914 0.81 ALDH1A1 (0.38) ALDH1A1HPGDRAB9ANPC1L3MBTL1
SCHEMBL19179591 0.81 ALDH1A1 (0.41) ALDH1A1HPGDRAB9ANPC1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114805133-A Aryl chloroformate preparation method 苏州星日化学有限公司 2022-07-29 CN disclosed
EP-1534531-A4 PRODUCT AUTHENTICATION APPLETON PAPER INC (US) 2006-09-13 EP disclosed
US-6939826-B2 Package, comprising a data storage device, packaging material, and an authentication system APPLETON PAPERS, INC. (US) 2005-09-06 US disclosed
EP-1534531-A1 PRODUCT AUTHENTICATION Appleton Papers Inc. (US) 2005-06-01 EP disclosed
US-20050023821-A1 Product authentication APPLETON PAPERS INC. (US) 2005-02-03 US disclosed
WO-2004000570-A1 PRODUCT AUTHENTICATION APPLETON PAPERS INC. (US) 2003-12-31 WO disclosed
US-20030236165-A1 Package, comprising a data storage device, packaging material, and an authentication system APPLETON PAPERS INC. 2003-12-25 US disclosed
EP-0319283-A2 Thermally responsive record material APPLETON PAPERS INC. (US) 1989-06-07 EP disclosed