SCHEMBL28660293

SCHEMBL28660293

OB(O)c1ccc(-c2cccc3c4ccccc4n(-c4ccccc4)c23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ATM Q13315 1/20 0.46
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
MGLL Q99685 2/20 0.42
DUSP3 P51452 1/20 0.42
KMT2A Q03164 2/20 0.37
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
ENPP2 Q13822 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CA5B Q9Y2D0 1/20 0.35
MAPK8 P45983 1/20 0.34
IL1R1 P14778 1/20 0.34
HDAC4 P56524 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL14296000 0.88 L3MBTL1 (0.59) L3MBTL1KDM4EATMDUSP3KMT2A
SCHEMBL14296086 0.87 L3MBTL1 (0.57) L3MBTL1KDM4EATMDUSP3KMT2A
SCHEMBL854803 0.86 MGLL (0.47) L3MBTL1KDM4EATMCA1CA2
SCHEMBL18435975 0.85 L3MBTL1 (0.55) L3MBTL1KDM4EATMDUSP3KMT2A
SCHEMBL16491724 0.85 L3MBTL1 (0.59) L3MBTL1KDM4EATMDUSP3KMT2A
SCHEMBL27864407 0.84 KDM4E (0.50) L3MBTL1KDM4EATMDUSP3KMT2A
SCHEMBL17245383 0.84 L3MBTL1 (0.53) L3MBTL1KDM4EATMDUSP3KMT2A
SCHEMBL14296128 0.84 L3MBTL1 (0.53) L3MBTL1KDM4EATMDUSP3KMT2A
SCHEMBL25674910 0.84 L3MBTL1 (0.58) L3MBTL1KDM4EATMDUSP3KMT2A
SCHEMBL20232314 0.84 L3MBTL1 (0.58) L3MBTL1KDM4EATMDUSP3KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113651807-A Compound and application thereof 北京鼎材科技有限公司 2021-11-16 CN disclosed