SCHEMBL28383676

SCHEMBL28383676

O=C(C1=CC2=CC3=NC(=CC4=NC(=CC5=NC(=CC1=N2)C=C5)C=C4)C=C3)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.37
▸ KMT2A Q03164 5/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ MAPT P10636 4/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ ALOX15 P16050 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ SRD5A2 P31213 1/20 0.33
▸ HTT P42858 1/20 0.33

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
SCHEMBL1275382 0.69 MAOA (0.31) —
SCHEMBL11331090 0.69 MAOA (0.31) —
SCHEMBL5013734 0.67 LTA4H (0.33) —
SCHEMBL455574 0.65 FGFR1 (0.35) —
Phenylboronic Acid SCHEMBL23535164 0.64 ENPP2 (0.54) ALDH1A1KDM4E
Benzaldehyde SCHEMBL87619 0.64 ALDH1A1 (0.54) ALDH1A1KMT2AHSD17B10LMNAKDM4E
Methyl Alcohol SCHEMBL8822147 0.62 — —
Benzophenone SCHEMBL8749839 0.62 ALDH1A1 (0.93) ALDH1A1KMT2AMEN1MAPTHSD17B10
Benzophenone SCHEMBL9860313 0.62 ALDH1A1 (0.93) ALDH1A1KMT2AMEN1MAPTHSD17B10
SCHEMBL78010 0.62 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116718649-B Electrochemiluminescence immunosensor and application thereof 苏州大学 2024-06-21 — — CN claimed
CN-116718649-A Electrochemiluminescence immunosensor and application thereof 苏州大学 2023-09-08 — — CN claimed
CN-113429430-A Porphyrin-based covalent organic framework material and preparation method and application method thereof 常州大学 2021-09-24 — — CN claimed
CN-116718649-B Electrochemiluminescence immunosensor and application thereof 苏州大学 2024-06-21 — — CN disclosed
CN-116718649-A Electrochemiluminescence immunosensor and application thereof 苏州大学 2023-09-08 — — CN disclosed
CN-113429430-A Porphyrin-based covalent organic framework material and preparation method and application method thereof 常州大学 2021-09-24 — — CN disclosed
CN-113429430-A Porphyrin-based covalent organic framework material and preparation method and application method thereof 常州大学 2021-09-24 — — CN disclosed
CN-110882218-A Liposome composition and preparation and application thereof 北京大学 2020-03-17 — — CN disclosed
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