SCHEMBL25916797

SCHEMBL25916797

COCCOc1ccc(C(=O)Oc2ccc(/C=C(\C#N)C(=O)OC3COC4CCOC43)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.43
▸ KDM4E B2RXH2 6/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ MAPT P10636 7/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ TDP1 Q9NUW8 3/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ LMNA P02545 3/20 0.38
▸ HSP90AA1 P07900 1/20 0.38
▸ APP P05067 3/20 0.38
▸ MEN1 O00255 2/20 0.37
▸ RAB9A P51151 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ MITF O75030 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ NFKB2 Q00653 1/20 0.35
▸ RELA Q04206 1/20 0.35

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
SCHEMBL21707413 0.89 ALDH1A1 (0.40) ALDH1A1KDM4ESMN1; SMN2MAPTKMT2A
SCHEMBL25916716 0.89 ALDH1A1 (0.47) ALDH1A1KDM4ESMN1; SMN2MAPTKMT2A
SCHEMBL26645708 0.87 ALDH1A1 (0.37) ALDH1A1KDM4ESMN1; SMN2MAPTKMT2A
SCHEMBL23312793 0.85 ALDH1A1 (0.46) ALDH1A1KDM4ESMN1; SMN2MAPTKMT2A
SCHEMBL21901652 0.85 ALDH1A1 (0.46) ALDH1A1KDM4ESMN1; SMN2MAPTKMT2A
SCHEMBL22844824 0.81 ALDH1A1 (0.49) ALDH1A1KDM4ESMN1; SMN2MAPTKMT2A
SCHEMBL21707397 0.80 ALDH1A1 (0.39) ALDH1A1KDM4ESMN1; SMN2MAPTKMT2A
SCHEMBL25718247 0.79 KDM4E (0.55) ALDH1A1KDM4ESMN1; SMN2MAPTKMT2A
SCHEMBL26013550 0.79 KDM4E (0.55) ALDH1A1KDM4ESMN1; SMN2MAPTKMT2A
SCHEMBL25916759 0.79 ALDH1A1 (0.44) ALDH1A1KDM4ESMN1; SMN2MAPTKMT2A

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
EP-4036131-B1 IMAGE RECORDING METHOD FUJIFILM CORP (JP) 2023-08-02 — — EP disclosed
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