SCHEMBL3764879

SCHEMBL3764879

C=CC(=O)OC(C)CC(C)(C)N

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.41
ALDH1A1 P00352 4/20 0.32
HIF1A Q16665 4/20 0.32
TP53 P04637 3/20 0.32
CYP3A4 P08684 3/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.31
THRB P10828 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
Hydrochloric Acid SCHEMBL2019274 0.98 TSHR (0.40) TSHRALDH1A1HIF1ATP53CYP3A4
Bromide SCHEMBL26661212 0.98 TSHR (0.40) TSHRALDH1A1HIF1ATP53CYP3A4
Sulfuric Acid SCHEMBL28894458 0.93 TSHR (0.37) TSHR
SCHEMBL28402795 0.89 TSHR (0.34) TSHR
SCHEMBL26100094 0.87 TSHR (0.33) TSHR
SCHEMBL23494088 0.85 TSHR (0.44) TSHRALDH1A1HIF1ATP53CYP3A4
SCHEMBL4655027 0.83 TSHR (0.42) TSHRALDH1A1HIF1ATP53CYP3A4
SCHEMBL4399493 0.82 TSHR (0.39) TSHRALDH1A1HIF1ATP53CYP3A4
SCHEMBL8619029 0.81 TSHR (0.41) TSHRALDH1A1HIF1ATP53CYP3A4
SCHEMBL10611134 0.81 TSHR (0.41) TSHRALDH1A1HIF1ATP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023190415-A1 RECORDING PAPER 株式会社ユポ・コーポレーション 2023-10-05 WO disclosed
CN-111971116-B Dispersant composition, coloring composition and color filter 大塚化学株式会社 2022-06-28 CN disclosed
EP-2770031-B1 WATER-ACTIVATED SHEET, WATER-ACTIVATED LABEL USING SAID SHEET, PRODUCTION METHOD FOR SAID LABEL, LABEL ADHERING DEVICE USING SAID LABEL, AND ADHEREND FOR SAID LABEL YUPO CORP (JP) 2017-09-06 EP disclosed
EP-1980544-B1 Process for producing powder KAO CORP (JP) 2016-11-16 EP disclosed
EP-1693352-B1 SURFACTANT COMPOSITION KAO CORP (JP) 2016-03-23 EP disclosed
EP-2770031-A1 WATER-ACTIVATED SHEET, WATER-ACTIVATED LABEL USING SAID SHEET, PRODUCTION METHOD FOR SAID LABEL, LABEL ADHERING DEVICE USING SAID LABEL, AND ADHEREND FOR SAID LABEL Yupo Corporation (JP) 2014-08-27 EP disclosed
US-20140234593-A1 WATER ACTIVATABLE SHEET, WATER ACTIVATABLE LABEL USING THE SHEET, METHOD FOR PRODUCING THE LABEL, LABEL APPLYING APPARATUS USING THE LABEL, AND ADHEREND HAVING THE LABEL YUPO CORPORATION (JP) 2014-08-21 US disclosed
US-7846876-B2 Surfactant composition KAO CORPORATION (JP) 2010-12-07 US disclosed
US-20080262129-A1 mixing an anionic aromatic compound (sodium p-toluenesulfonate), a cationic surfactant polydiallyldimethylammonium chloride and water to obtain a viscous material and feeding the viscous material heated at the specific temperature to the drying step; less caking; modifying the rheology KAO CORPORATION (JP) 2008-10-23 US disclosed
EP-1980544-A2 Process for producing powder Kao Corporation (JP) 2008-10-15 EP disclosed
US-20080058227-A1 Surfactant Composition KAO CORPORATION (JP) 2008-03-06 US disclosed
EP-1693352-A1 SURFACTANT COMPOSITION Kao Corporation (JP) 2006-08-23 EP disclosed