SCHEMBL28117942

SCHEMBL28117942

NC(COC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.62
▸ SLC1A5 Q15758 1/20 0.55
▸ TDP1 Q9NUW8 2/20 0.55
▸ SLC6A2 P23975 1/20 0.55
▸ SLC6A3 Q01959 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ SCN4A P35499 3/20 0.50
▸ ADRB2 P07550 2/20 0.50
▸ ADRB1 P08588 2/20 0.50
▸ ADRB3 P13945 2/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ LMNA P02545 3/20 0.49
▸ KDM4E B2RXH2 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL21590344 0.89 HPGD (0.55) ALDH1A1SLC1A5TDP1SLC6A2SLC6A3
SCHEMBL21523101 0.85 LMNA (0.63) ALDH1A1TDP1KMT2AMAPK1LMNA
SCHEMBL21523100 0.85 LMNA (0.63) ALDH1A1TDP1KMT2AMAPK1LMNA
SCHEMBL25437225 0.84 ALDH1A1 (0.45) ALDH1A1SLC1A5TDP1SLC6A2SLC6A3
SCHEMBL7909113 0.84 TDP1 (0.59) ALDH1A1SLC1A5TDP1SLC6A2SLC6A3
SCHEMBL7908767 0.84 TDP1 (0.59) ALDH1A1SLC1A5TDP1SLC6A2SLC6A3
SCHEMBL571207 0.81 ALDH1A1 (0.67) ALDH1A1SLC1A5TDP1SLC6A2SLC6A3
SCHEMBL8645117 0.81 CYP1A2 (0.70) SLC6A3SCN4AMAPK1LMNAKDM4E
SCHEMBL12682028 0.81 CYP1A2 (0.70) SLC6A3SCN4AMAPK1LMNAKDM4E
SCHEMBL4579269 0.81 CYP1A2 (0.70) SLC6A3SCN4AMAPK1LMNAKDM4E

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
CN-120001297-A Capsule 宝洁公司 2025-05-16 — — CN disclosed
CN-113660926-B capsule 宝洁公司 2025-03-07 — — CN disclosed
CN-114007734-B Method for preparing capsules 宝洁公司 2025-01-17 — — CN disclosed
CN-114007734-A Method for preparing capsules 宝洁公司 2022-02-01 — — CN disclosed
CN-113660926-A Capsule 宝洁公司 2021-11-16 — — CN disclosed
CN-113631695-A Capsule 宝洁公司 2021-11-09 — — CN disclosed
CN-103261156-B For treating the noval chemical compound of neurodegenerative disease 鲁汶天主教大学研究开发部 2016-12-28 — — CN disclosed
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