SCHEMBL25916716

SCHEMBL25916716

COCCCCOc1ccc(/C=C(\C#N)C(=O)OC2COC3CCOC32)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ APP P05067 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.36
▸ CACNA1B Q00975 1/20 0.36
▸ APBA1 Q02410 1/20 0.36

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
SCHEMBL23312793 0.93 ALDH1A1 (0.46) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL21901652 0.93 ALDH1A1 (0.46) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL25916797 0.89 ALDH1A1 (0.43) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL21707413 0.85 ALDH1A1 (0.40) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL25718247 0.84 KDM4E (0.55) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL26013550 0.84 KDM4E (0.55) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL25916759 0.83 ALDH1A1 (0.44) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL26645708 0.82 ALDH1A1 (0.37) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL20827817 0.81 ALDH1A1 (0.47) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1
SCHEMBL21793545 0.81 ALDH1A1 (0.47) ALDH1A1KDM4ESMN1; SMN2KMT2AMEN1

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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