SCHEMBL3272863

SCHEMBL3272863

C=C[C@H]1CN2CC[C@H]1C[C@H]2[C@H](OO)c1ccnc2ccc(OC)cc12

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.82
CYP2D6 P10635 6/20 0.82
ALDH1A1 P00352 5/20 0.82
ABCB1 P08183 4/20 0.82
SLC22A1 O15245 3/20 0.82
ABCB11 O95342 3/20 0.82
ADRA2A P08913 3/20 0.82
SLC6A4 P31645 3/20 0.82
OPRM1 P35372 3/20 0.82
SCN1A P35498 3/20 0.82
KCNH2 Q12809 3/20 0.82
SCN2A Q99250 3/20 0.82
SCN3A Q9NY46 3/20 0.82
CYP3A4 P08684 3/20 0.82
HSD17B10 Q99714 3/20 0.82
SLC22A2 O15244 2/20 0.82
MEN1 O00255 2/20 0.82
KMT2A Q03164 2/20 0.82
THRB P10828 1/20 0.82
ABCC4 O15439 1/20 0.82

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
SCHEMBL5307109 1.00 KDM4E (0.82) KDM4ECYP2D6ALDH1A1ABCB1SLC22A1
SCHEMBL25588913 0.93 KDM4E (0.82) KDM4ECYP2D6ALDH1A1ABCB1SLC22A1
SCHEMBL3673224 0.93 KDM4E (0.82) KDM4ECYP2D6ALDH1A1ABCB1SLC22A1
SCHEMBL3680691 0.93 KDM4E (0.82) KDM4ECYP2D6ALDH1A1ABCB1SLC22A1
SCHEMBL10102474 0.93 KDM4E (0.82) KDM4ECYP2D6ALDH1A1ABCB1SLC22A1
SCHEMBL10102106 0.93 KDM4E (0.82) KDM4ECYP2D6ALDH1A1ABCB1SLC22A1
SCHEMBL6549252 0.93 KDM4E (0.82) KDM4ECYP2D6ALDH1A1ABCB1SLC22A1
SCHEMBL3677893 0.91 KDM4E (0.77) KDM4ECYP2D6ALDH1A1ABCB1SLC22A1
SCHEMBL5866995 0.91 KDM4E (0.79) KDM4ECYP2D6ALDH1A1ABCB1SLC22A1
SCHEMBL10936769 0.91 KDM4E (0.79) KDM4ECYP2D6ALDH1A1ABCB1SLC22A1

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013079187-A9 TASTE-MASKING COMPOSITIONS, SWEETENER COMPOSITIONS AND CONSUMABLE PRODUCT COMPOSITIONS CONTAINING THE SAME NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2016-04-14 WO claimed
EP-2785199-A2 TASTE-MASKING COMPOSITIONS, SWEETENER COMPOSITIONS AND CONSUMABLE PRODUCT COMPOSITIONS CONTAINING THE SAME Nutrinova Nutrition Specialties & Food Ingredients GmbH (DE) 2014-10-08 EP claimed
WO-2013079187-A2 TASTE-MASKING COMPOSITIONS, SWEETENER COMPOSITIONS AND CONSUMABLE PRODUCT COMPOSITIONS CONTAINING THE SAME NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2013-06-06 WO claimed
US-20130136839-A1 Taste-Masking Compositions, Sweetener Compositions and Consumable Product Compositions Containing the Same NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2013-05-30 US claimed
US-20130136836-A1 Taste-Masking Compositions, Sweetener Compositions and Consumable Product Compositions Containing the Same NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2013-05-30 US claimed
CN-115389496-A Quinoline is TLC color development device for product 常州琦诺生物科技有限公司 2022-11-25 CN disclosed
CN-110507655-B Application of compound FG-4592 in preparation of pharmaceutical preparation for treating thyroid hormone receptor mediated diseases 厦门大学 2022-10-28 CN disclosed
CN-110129030-B Preparation and application of block polymer nano-material fluorescent probe with stimulus responsiveness 福建师范大学 2022-04-26 CN disclosed
EP-3236778-A1 TASTE MODIFYING COMPOSITIONS Celanese Sales Germany GmbH (DE) 2017-11-01 EP disclosed
EP-3236776-A1 TASTE MODIFYING COMPOSITIONS Celanese Sales Germany GmbH (DE) 2017-11-01 EP disclosed
EP-3236777-A1 TASTE MODIFYING COMPOSITIONS Celanese Sales Germany GmbH (DE) 2017-11-01 EP disclosed
US-20160183576-A1 TASTE MODIFYING COMPOSITIONS CELANESE SALES GERMANY GMBH (DE) 2016-06-30 US disclosed
WO-2016103182-A1 TASTE MODIFYING COMPOSITIONS CELANESE SALES GERMANY GMBH (DE) 2016-06-30 WO disclosed
WO-2013079187-A9 TASTE-MASKING COMPOSITIONS, SWEETENER COMPOSITIONS AND CONSUMABLE PRODUCT COMPOSITIONS CONTAINING THE SAME NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2016-04-14 WO disclosed
EP-2785199-A2 TASTE-MASKING COMPOSITIONS, SWEETENER COMPOSITIONS AND CONSUMABLE PRODUCT COMPOSITIONS CONTAINING THE SAME Nutrinova Nutrition Specialties & Food Ingredients GmbH (DE) 2014-10-08 EP disclosed
WO-2013079187-A2 TASTE-MASKING COMPOSITIONS, SWEETENER COMPOSITIONS AND CONSUMABLE PRODUCT COMPOSITIONS CONTAINING THE SAME NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2013-06-06 WO disclosed
US-20130136836-A1 Taste-Masking Compositions, Sweetener Compositions and Consumable Product Compositions Containing the Same NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2013-05-30 US disclosed
US-20130136839-A1 Taste-Masking Compositions, Sweetener Compositions and Consumable Product Compositions Containing the Same NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2013-05-30 US disclosed
US-7692189-B2 Polarization-type molecular color switch HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2010-04-06 US disclosed
US-20080266647-A1 Polarization-type molecular color switch HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2008-10-30 US disclosed