SCHEMBL24089835

SCHEMBL24089835

CN(CCO)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4s3)oc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.52
▸ KMT2A Q03164 7/20 0.52
▸ MAPT P10636 6/20 0.52
▸ RECQL P46063 4/20 0.52
▸ LMNA P02545 4/20 0.52
▸ RAB9A P51151 3/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ HPGD P15428 2/20 0.52
▸ NFKB1 P19838 1/20 0.52
▸ NFKB2 Q00653 1/20 0.52
▸ RELA Q04206 1/20 0.52
▸ KDM4E B2RXH2 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ APEX1 P27695 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ SAE1 Q9UBE0 1/20 0.47
▸ UBA2 Q9UBT2 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.45
▸ HTT P42858 1/20 0.45
▸ TLR9 Q9NR96 1/20 0.45

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
SCHEMBL21037454 0.86 MEN1 (0.46) MEN1KMT2AMAPTRECQLLMNA
SCHEMBL21160097 0.83 MEN1 (0.47) MEN1KMT2AMAPTRECQLLMNA
SCHEMBL24089756 0.83 MAPT (0.48) MEN1KMT2AMAPTLMNARAB9A
SCHEMBL21037425 0.83 MEN1 (0.61) MEN1KMT2AMAPTRECQLLMNA
SCHEMBL21037408 0.82 APP (0.51) MEN1KMT2AMAPTRECQLLMNA
SCHEMBL24089838 0.80 MEN1 (0.58) MEN1KMT2AMAPTRECQLLMNA
SCHEMBL24089748 0.77 MEN1 (0.43) MEN1KMT2AMAPTRECQLLMNA
SCHEMBL24089635 0.77 MEN1 (0.42) MEN1KMT2AMAPTRECQLLMNA
SCHEMBL21036839 0.76 MEN1 (0.44) MEN1KMT2AMAPTRECQLLMNA
SCHEMBL21036989 0.76 MEN1 (0.49) MEN1KMT2AMAPTRECQLLMNA

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
US-20210382060-A1 FLUORESCENT PROBE AND PREPARATION METHOD AND USE THEREOF Shanghai Glory Capital Management Ltd. (CN) 2021-12-09 — — US disclosed
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