SCHEMBL30159697

SCHEMBL30159697

CCOc1ccc(C=O)cc1OCC

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.73
TACR2 P21452 1/20 0.69
MAPT P10636 3/20 0.64
HPGD P15428 2/20 0.64
TDP1 Q9NUW8 2/20 0.64
L3MBTL1 Q9Y468 2/20 0.64
NPSR1 Q6W5P4 2/20 0.64
KDM4E B2RXH2 3/20 0.62
FDPS P14324 1/20 0.62
TSHR P16473 1/20 0.57
LMNA P02545 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
HTT P42858 1/20 0.54
GAA P10253 2/20 0.52
RXFP1 Q9HBX9 1/20 0.52
KMT2A Q03164 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
SCHEMBL493684 1.00 ALDH1A1 (0.73) ALDH1A1TACR2MAPTHPGDTDP1
SCHEMBL11212209 0.91 ALDH1A1 (0.64) ALDH1A1TACR2MAPTHPGDTDP1
SCHEMBL4948728 0.91 ALDH1A1 (0.64) ALDH1A1TACR2MAPTHPGDTDP1
SCHEMBL754958 0.91 ALDH1A1 (0.72) ALDH1A1TACR2MAPTHPGDTDP1
SCHEMBL30416638 0.91 ALDH1A1 (0.72) ALDH1A1TACR2MAPTHPGDTDP1
SCHEMBL356800 0.91 FDPS (0.77) ALDH1A1TACR2MAPTHPGDTDP1
SCHEMBL13221144 0.90 ALDH1A1 (0.63) ALDH1A1TACR2MAPTHPGDTDP1
SCHEMBL2679839 0.90 ALDH1A1 (0.62) ALDH1A1TACR2MAPTHPGDTDP1
SCHEMBL23457684 0.89 ALDH1A1 (0.63) ALDH1A1TACR2MAPTHPGDTDP1
SCHEMBL25587623 0.89 ALDH1A1 (0.63) ALDH1A1TACR2MAPTHPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119708075-A Iridium complex for mitochondrial viscosity dynamic detection and tumor differentiation and preparation method and application thereof 安徽中医药大学 2025-03-28 CN claimed
CN-118994258-A N-type terpyridine platinum complex and preparation method and application thereof 山东海化集团有限公司 2024-11-22 CN claimed
CN-118724978-A Schiff base iridium complex for photodynamic therapy and preparation method and application thereof 安徽中医药大学 2024-10-01 CN claimed
CN-120136683-A Catechol ether compound, pharmaceutical composition and application thereof 中国药科大学 2025-06-13 CN disclosed
CN-119708075-A Iridium complex for mitochondrial viscosity dynamic detection and tumor differentiation and preparation method and application thereof 安徽中医药大学 2025-03-28 CN disclosed
CN-118994258-A N-type terpyridine platinum complex and preparation method and application thereof 山东海化集团有限公司 2024-11-22 CN disclosed
CN-118772147-A Tadalafil derivative and preparation method and application thereof 山东省药学科学院 2024-10-15 CN disclosed
CN-118724978-A Schiff base iridium complex for photodynamic therapy and preparation method and application thereof 安徽中医药大学 2024-10-01 CN disclosed
CN-117820324-A Benzimidazole spiro hybrid and medical application thereof 长治学院 2024-04-05 CN disclosed
CN-113773202-B Polysubstituted phenanthrene compound, preparation method and application thereof 北京理工大学 2022-12-27 CN disclosed