SCHEMBL29488478

SCHEMBL29488478

O=C(CCCC/C=C(\COc1cccc2ccccc12)C(=O)NCCCn1ccnc1)NO

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ PKM P14618 2/20 0.50
▸ KDM4E B2RXH2 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ QPCT Q16769 1/20 0.45
▸ IDE P14735 3/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ USP2 O75604 1/20 0.42
▸ ALOX12 P18054 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ GAA P10253 1/20 0.41
▸ POLB P06746 1/20 0.41

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
SCHEMBL1305248 1.00 L3MBTL1 (0.50) L3MBTL1ALDH1A1PKMKDM4ESMN1; SMN2
SCHEMBL1305250 1.00 L3MBTL1 (0.50) L3MBTL1ALDH1A1PKMKDM4ESMN1; SMN2
SCHEMBL1306376 0.92 KDM4E (0.50) L3MBTL1ALDH1A1PKMKDM4ESMN1; SMN2
SCHEMBL1306379 0.92 KDM4E (0.50) L3MBTL1ALDH1A1PKMKDM4ESMN1; SMN2
SCHEMBL1306260 0.91 ALDH1A1 (0.52) L3MBTL1ALDH1A1PKMKDM4ESMN1; SMN2
SCHEMBL1306262 0.91 ALDH1A1 (0.52) L3MBTL1ALDH1A1PKMKDM4ESMN1; SMN2
SCHEMBL1306647 0.86 L3MBTL1 (0.47) L3MBTL1ALDH1A1PKMKDM4ESMN1; SMN2
SCHEMBL1306640 0.86 L3MBTL1 (0.47) L3MBTL1ALDH1A1PKMKDM4ESMN1; SMN2
SCHEMBL1306643 0.86 L3MBTL1 (0.47) L3MBTL1ALDH1A1PKMKDM4ESMN1; SMN2
SCHEMBL1306264 0.84 ALDH1A1 (0.49) L3MBTL1ALDH1A1PKMKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4026544-A1 PHARMACEUTICAL COMPOSITION COMPRISING HDAC INHIBITOR AND ANTI-PD1 ANTIBODY OR ANTI PD-L1 ANTIBODY Crystalgenomics, Inc. (KR) 2022-07-13 — — EP claimed
CN-114340672-A Pharmaceutical composition comprising an HDAC inhibitor and an anti-PD 1 antibody or an anti-PD-L1 antibody 晶体基因技术株式会社 2022-04-12 — — CN claimed
CN-112930177-B Pharmaceutical compositions containing alkylcarbamoyl naphthoyl octenoyl hydroxyamide phosphate, tartrate or combinations thereof and methods of making the same 晶体基因技术株式会社 2024-01-30 — — CN disclosed
EP-4155292-A1 METHOD FOR PRODUCING PHARMACEUTICALLY ACCEPTABLE SALT OF ALKYLCARBAMOYL NAPHTHALENYLOXY OCTENOYLHYDROXYAMIDE Crystalgenomics, Inc. (KR) 2023-03-29 — — EP disclosed
EP-4026544-A1 PHARMACEUTICAL COMPOSITION COMPRISING HDAC INHIBITOR AND ANTI-PD1 ANTIBODY OR ANTI PD-L1 ANTIBODY Crystalgenomics, Inc. (KR) 2022-07-13 — — EP disclosed
CN-114340672-A Pharmaceutical composition comprising an HDAC inhibitor and an anti-PD 1 antibody or an anti-PD-L1 antibody 晶体基因技术株式会社 2022-04-12 — — CN disclosed
CN-110740989-B Pharmaceutically acceptable salts of alkylcarbamoylnaphthoxyoctenoylhydroxyamides or derivatives thereof and process for preparing the same 晶体基因技术株式会社 2022-03-08 — — CN disclosed
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