SCHEMBL27620599

SCHEMBL27620599

NC1(F)C=CC(C(=O)c2ccccc2)=CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
L3MBTL1 Q9Y468 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
ATM Q13315 1/20 0.35
SRD5A2 P31213 1/20 0.35
MAPT P10636 4/20 0.35
GAA P10253 1/20 0.35
HPGDS O60760 1/20 0.34
PBRM1 Q86U86 1/20 0.34
HSD17B10 Q99714 4/20 0.33
LMNA P02545 3/20 0.33
TSHR P16473 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HTT P42858 1/20 0.33
AKR1C3 P42330 1/20 0.33
POLB P06746 1/20 0.33
CYP3A4 P08684 1/20 0.33
PARP1 P09874 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL993046 0.85 ALDH1A1 (0.43) ALDH1A1L3MBTL1TDP1ATMSRD5A2
SCHEMBL528382 0.84 ALDH1A1 (0.42) ALDH1A1L3MBTL1TDP1ATMSRD5A2
SCHEMBL19179591 0.83 ALDH1A1 (0.41) ALDH1A1L3MBTL1TDP1ATMSRD5A2
SCHEMBL4959091 0.83 ALDH1A1 (0.41) ALDH1A1L3MBTL1TDP1ATMSRD5A2
SCHEMBL27557280 0.83 ALDH1A1 (0.41) ALDH1A1L3MBTL1TDP1ATMSRD5A2
Benzophenone SCHEMBL28991975 0.83 ALDH1A1 (0.45) ALDH1A1L3MBTL1TDP1ATMSRD5A2
SCHEMBL7423422 0.81 ALDH1A1 (0.39) ALDH1A1L3MBTL1TDP1ATMSRD5A2
SCHEMBL7430914 0.81 ALDH1A1 (0.39) ALDH1A1L3MBTL1TDP1ATMSRD5A2
SCHEMBL26630609 0.81 ALDH1A1 (0.39) ALDH1A1L3MBTL1TDP1ATMSRD5A2
SCHEMBL7420070 0.81 ALDH1A1 (0.39) ALDH1A1L3MBTL1TDP1ATMSRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1727364-A Photoinitiator of benzophenone containing maleimide base group, and preparation method UNIV SHANGHAI JIAOTONG (CN) 2006-02-01 CN claimed
CN-114805133-A Aryl chloroformate preparation method 苏州星日化学有限公司 2022-07-29 CN disclosed
CN-102126994-A Benzophenone hydrazone derivative and preparation method and application thereof SINOCHEM LANTIAN CO LTD 2011-07-20 CN disclosed
CN-1727364-A Photoinitiator of benzophenone containing maleimide base group, and preparation method UNIV SHANGHAI JIAOTONG (CN) 2006-02-01 CN disclosed