SCHEMBL29929549

SCHEMBL29929549

COc1ccc(-c2c(C(=O)O)c(C34CC5CC(CC(C5)C3)C4)cc3ccccc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
RARB P10826 4/20 0.47
RARG P13631 4/20 0.47
RARA P10276 3/20 0.47
LMNA P02545 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
NR1I2 O75469 1/20 0.47
PGR P06401 1/20 0.47
HSPD1 P10809 1/20 0.47
GOT1 P17174 1/20 0.47
GLRA1 P23415 1/20 0.47
BLM P54132 1/20 0.47
HSPE1 P61604 1/20 0.47
ALOX5 P09917 1/20 0.43
GPR84 Q9NQS5 1/20 0.43
THRB P10828 1/20 0.43
RECQL P46063 1/20 0.43
NR2E1 Q9Y466 1/20 0.43
KDM4E B2RXH2 3/20 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
SCHEMBL8322639 1.00 KMT2A (0.47) KMT2AMEN1RARBRARGRARA
SCHEMBL8322293 0.91 RARB (0.43) KMT2AMEN1RARBRARGRARA
SCHEMBL8322327 0.87 MEN1 (0.46) KMT2AMEN1RARBRARGRARA
SCHEMBL9317805 0.83 RARB (0.54) KMT2AMEN1RARBRARGRARA
SCHEMBL8572204 0.82 RARB (0.40) KMT2AMEN1RARBRARGRARA
SCHEMBL8583241 0.80 RARB (0.47) RARBRARGRARALMNATDP1
SCHEMBL17323573 0.77 MEN1 (0.45) KMT2AMEN1RARBRARGRARA
SCHEMBL29222875 0.76 WDR5 (0.45) KMT2AMEN1RARBRARGRARA
Anisole SCHEMBL8573067 0.76 KMT2A (0.38) KMT2AMEN1RARBRARGRARA
SCHEMBL9078624 0.75 KMT2A (0.47) KMT2AMEN1RARBRARGRARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115209861-B Oral care composition for gingival health 宝洁公司 2024-11-12 CN disclosed
CN-118742968-A Oral care based digital imaging system and method for evaluating oral care products 宝洁公司 2024-10-01 CN disclosed
CN-115209860-B Oral care composition for gingival health 宝洁公司 2024-09-06 CN disclosed
CN-118401234-A Blocked emulsion toothpaste compositions 宝洁公司 2024-07-26 CN disclosed
EP-4392010-A1 ORAL CARE COMPOSITIONS FOR GUM HEALTH The Procter & Gamble Company (US) 2024-07-03 EP disclosed
EP-4391992-A1 ORAL CARE COMPOSITIONS FOR GUM HEALTH The Procter & Gamble Company (US) 2024-07-03 EP disclosed
CN-118159250-A Blocked emulsion toothpaste compositions 宝洁公司 2024-06-07 CN disclosed
CN-118103025-A Blocked emulsion toothpaste compositions comprising fluoride 宝洁公司 2024-05-28 CN disclosed
CN-118103017-A Blocked emulsion toothpaste compositions 宝洁公司 2024-05-28 CN disclosed
CN-117835952-A Oral care composition for gingival health 宝洁公司 2024-04-05 CN disclosed
CN-117835961-A Oral care composition for gingival health 宝洁公司 2024-04-05 CN disclosed
CN-117083053-A Edible oral composition comprising hops 宝洁公司 2023-11-17 CN disclosed
WO-2023023884-A1 ORAL CARE COMPOSITIONS FOR GUM HEALTH THE PROCTER & GAMBLE COMPANY (US) 2023-03-02 WO disclosed
WO-2023023886-A1 ORAL CARE COMPOSITIONS FOR GUM HEALTH THE PROCTER & GAMBLE COMPANY (US) 2023-03-02 WO disclosed
EP-4110271-A1 ORAL CARE COMPOSITIONS FOR GUM HEALTH The Procter & Gamble Company (US) 2023-01-04 EP disclosed
EP-4110270-A1 ORAL CARE COMPOSITIONS FOR GUM HEALTH The Procter & Gamble Company (US) 2023-01-04 EP disclosed
CN-115209860-A Oral care compositions for gum health 宝洁公司 2022-10-18 CN disclosed
CN-115209861-A Oral care compositions for gum health 宝洁公司 2022-10-18 CN disclosed