SCHEMBL28960147

SCHEMBL28960147

[CH2]C(C(=O)c1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
LMNA P02545 5/20 0.54
CES1 P23141 4/20 0.54
CES2 O00748 3/20 0.54
ALDH1A1 P00352 3/20 0.50
TSHR P16473 2/20 0.50
DAO P14920 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
MDM2 Q00987 1/20 0.50
AKT1 P31749 1/20 0.46
MAPT P10636 3/20 0.46
CYP3A4 P08684 3/20 0.46
CA2 P00918 2/20 0.46
CA4 P22748 2/20 0.46
POLB P06746 1/20 0.46
PARP1 P09874 1/20 0.46
CYP2C19 P33261 1/20 0.46
RECQL P46063 1/20 0.46
BLM P54132 1/20 0.46

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
SCHEMBL4380823 0.82 CES1 (0.58) TDP1L3MBTL1LMNACES1CES2
SCHEMBL1167722 0.80 L3MBTL1 (0.52) TDP1L3MBTL1LMNACES1CES2
SCHEMBL4952955 0.80 TDP1 (0.52) TDP1L3MBTL1LMNACES1CES2
SCHEMBL932126 0.80 TDP1 (0.52) TDP1L3MBTL1LMNACES1CES2
SCHEMBL338162 0.80 TDP1 (0.52) TDP1L3MBTL1LMNACES1CES2
SCHEMBL27503110 0.80 TDP1 (0.52) TDP1L3MBTL1LMNACES1CES2
SCHEMBL9211939 0.80 TDP1 (0.52) TDP1L3MBTL1LMNACES1CES2
SCHEMBL6838801 0.78 TDP1 (0.61) TDP1L3MBTL1LMNACES1CES2
SCHEMBL1704713 0.78 TDP1 (0.61) TDP1L3MBTL1LMNACES1CES2
SCHEMBL599761 0.78 TDP1 (0.61) TDP1L3MBTL1LMNACES1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111972422-B Weeding composition containing microcapsules and preparation method and application thereof 江苏龙灯化学有限公司 2022-10-25 CN disclosed
CN-107573295-B Molecules and intermediates having pesticidal utility, compositions and methods relating thereto 美国陶氏益农公司 2020-12-15 CN disclosed