SCHEMBL26937995

SCHEMBL26937995

C=C(C)C(=O)OCCc1ccc(Nc2cccc3c2C(=O)c2cccc(Nc4ccc(CCOC(=O)C(=C)C)cc4)c2C3=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ MAOA P21397 1/20 0.40
▸ TERT O14746 7/20 0.38
▸ SIRT2 Q8IXJ6 3/20 0.36
▸ PABPC1 P11940 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ EGFR P00533 1/20 0.35
▸ CCNE2 O96020 1/20 0.35
▸ CDK4 P11802 1/20 0.35
▸ CCND1 P24385 1/20 0.35
▸ CCNE1 P24864 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
SCHEMBL4253388 0.97 MAPT (0.47) MAPTMAPK1RAB9ATDP1L3MBTL1
SCHEMBL29462117 0.91 MAPT (0.55) MAPTMAPK1RAB9ATDP1L3MBTL1
SCHEMBL261845 0.91 MAPT (0.55) MAPTMAPK1RAB9ATDP1L3MBTL1
SCHEMBL20274482 0.86 NPC1 (0.50) MAPTMAPK1RAB9ATDP1L3MBTL1
SCHEMBL16011446 0.86 MAPT (0.45) MAPTMAPK1RAB9ATDP1L3MBTL1
SCHEMBL13178023 0.86 MAPT (0.64) MAPTMAPK1RAB9ATDP1L3MBTL1
SCHEMBL23213406 0.85 MAOA (0.45) MAPTMAPK1RAB9ATDP1L3MBTL1
SCHEMBL9915558 0.84 NPC1 (0.48) MAPTMAPK1RAB9ATDP1L3MBTL1
SCHEMBL8032993 0.84 MAPT (0.47) MAPTMAPK1RAB9ATDP1L3MBTL1
SCHEMBL14838826 0.83 MEN1 (0.47) MAPTMAPK1RAB9ATDP1L3MBTL1

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-4172667-B1 COLOURED CONTACT LENS COOPERVISION INT LTD (GB) 2023-12-13 — — EP disclosed
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