SCHEMBL30383525

SCHEMBL30383525

O=C(/C=C/c1cccc(O)c1)c1ccc(OCC(=O)N2CCOCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 6/20 0.67
▸ NFE2L2 Q16236 6/20 0.67
▸ MAPT P10636 4/20 0.66
▸ NPC1 O15118 2/20 0.66
▸ RAB9A P51151 2/20 0.66
▸ ALDH1A1 P00352 6/20 0.57
▸ HTT P42858 2/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ LMNA P02545 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ FKBP1A P62942 5/20 0.53
▸ POLB P06746 1/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ RECQL P46063 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ ATM Q13315 1/20 0.53
▸ MAOA P21397 1/20 0.51
▸ MAOB P27338 1/20 0.51

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
SCHEMBL25198566 1.00 KEAP1 (0.67) KEAP1NFE2L2MAPTNPC1RAB9A
SCHEMBL25195089 0.90 KEAP1 (0.64) KEAP1NFE2L2MAPTNPC1RAB9A
SCHEMBL31233177 0.90 KEAP1 (0.64) KEAP1NFE2L2MAPTNPC1RAB9A
SCHEMBL25189629 0.88 KEAP1 (0.67) KEAP1NFE2L2MAPTALDH1A1HTT
SCHEMBL25212469 0.88 KEAP1 (0.67) KEAP1NFE2L2MAPTALDH1A1HTT
SCHEMBL30383954 0.83 KEAP1 (0.69) KEAP1NFE2L2MAPTALDH1A1KDM4E
SCHEMBL25198003 0.83 KEAP1 (0.69) KEAP1NFE2L2MAPTALDH1A1KDM4E
SCHEMBL25223384 0.83 KEAP1 (0.69) KEAP1NFE2L2MAPTALDH1A1KDM4E
SCHEMBL25237875 0.82 ALDH1A1 (0.59) KEAP1NFE2L2MAPTNPC1RAB9A
SCHEMBL25221774 0.80 MAPT (1.00) KEAP1NFE2L2MAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4429763-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS Yewsavin, Inc. (US) 2024-09-18 — — EP disclosed
WO-2023086388-A1 COMPOSITIONS AND METHODS FOR TREATING BLEEDING AND BLEEDING DISORDERS YewSavin, Inc. (US) 2023-05-19 — — WO disclosed
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