SCHEMBL3838892

SCHEMBL3838892

C=C(C)C(=O)OC(C)C.[Ti]

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
ALDH1A1 P00352 3/20 0.48
ADRA1A P35348 1/20 0.39
PDE4D Q08499 1/20 0.39
THRB P10828 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
HCAR2 Q8TDS4 1/20 0.34
LMNA P02545 3/20 0.33
HSD17B10 Q99714 2/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 1/20 0.33
USP2 O75604 1/20 0.33
CA12 O43570 4/20 0.31
CA1 P00915 4/20 0.31
CA2 P00918 4/20 0.31
CA9 Q16790 4/20 0.31
CA7 P43166 3/20 0.31
CA14 Q9ULX7 3/20 0.31

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
SCHEMBL15253 0.97
SCHEMBL21772350 0.97 TSHR (0.52) TSHRALDH1A1ADRA1APDE4DTHRB
Water SCHEMBL27744037 0.95 TSHR (0.50) TSHRALDH1A1ADRA1APDE4DTHRB
Ethylene SCHEMBL27854424 0.95 TSHR (0.50) TSHRALDH1A1ADRA1APDE4DTHRB
Ammonia Solution, Strong SCHEMBL28141794 0.95 TSHR (0.50) TSHRALDH1A1ADRA1APDE4DTHRB
Fluoride SCHEMBL28010993 0.95 TSHR (0.50) TSHRALDH1A1ADRA1APDE4DTHRB
Oxalic Acid SCHEMBL7518307 0.90 TSHR (0.46) TSHRALDH1A1ADRA1APDE4DTHRB
Methacrylic Acid SCHEMBL6131252 0.90 TSHR (0.46) TSHRALDH1A1ADRA1APDE4DTHRB
Trimethylammonium SCHEMBL21714443 0.90 TSHR (0.46) TSHRALDH1A1ADRA1APDE4DTHRB
Benzene SCHEMBL27682798 0.90 TSHR (0.46) TSHRALDH1A1ADRA1APDE4DTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104570632-B Toner CANON K. K. (JP) 2018-08-31 CN disclosed
EP-0983041-B1 AQUEOUS CARRIER SYSTEMS FOR WATER-INSOLUBLE MATERIALS OREAL (FR) 2009-10-07 EP disclosed
US-20050061349-A1 Two-step mascara L'OREAL S.A. (FR) 2005-03-24 US disclosed
US-20050061348-A1 Two-step mascara L'OREAL S.A. (FR) 2005-03-24 US disclosed
EP-1516612-A2 Two-step mascara l'Oreal SA (FR) 2005-03-23 EP disclosed
US-6221389-B1 AT LEAST ONE ORGANIC PHOSPHOLIPID CAPABLE OF FORMING BILAYERS IN AQUEOUS SOLUTION;AT LEAST ONE AMPHOTERIC SURFACTANT; AND AT LEAST ONE NONIONIC SURFACTANT PRESENT IN AN AMOUNT BY WEIGHT EQUAL TO OR GREATER THAN THE AMOUNT OF THE PHOSPHOLIPID. L'OREAL (FR) 2001-04-24 US disclosed
EP-0983041-A1 AQUEOUS CARRIER SYSTEMS FOR WATER-INSOLUBLE MATERIALS L'OREAL (FR) 2000-03-08 EP disclosed
WO-1998056333-A9 AQUEOUS CARRIER SYSTEMS FOR WATER-INSOLUBLE MATERIALS OREAL (FR) 1999-04-08 WO disclosed
WO-1998056333-A1 AQUEOUS CARRIER SYSTEMS FOR WATER-INSOLUBLE MATERIALS L'OREAL (FR) 1998-12-17 WO disclosed