SCHEMBL16932995

SCHEMBL16932995

CC(O)c1cc(C(C)O)c(N)cc1N

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.37
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
ALOX12 P18054 1/20 0.33
HTT P42858 1/20 0.33
HIF1A Q16665 1/20 0.33
PDE2A O00408 1/20 0.32

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
SCHEMBL4640070 0.80 CYP3A4 (0.50) ALDH1A1GAAHIF1A
SCHEMBL93992 0.79 GAA (0.52) ALDH1A1GAAHTTPDE2A
SCHEMBL6575831 0.77 ACHE (0.41) ALDH1A1GAAALOX12HTTHIF1A
SCHEMBL15310450 0.77 UGT2B7 (0.48) ALDH1A1HIF1A
SCHEMBL19254874 0.77 GAA (0.48) ALDH1A1GAA
SCHEMBL117750 0.77 PTK2 (0.41) PTK2ALDH1A1GAAALOX12HTT
SCHEMBL25588908 0.75 ADRB2 (0.41) ALDH1A1GAAALOX12HTTHIF1A
SCHEMBL446559 0.75 ALDH1A1 (0.41) ALDH1A1GAAALOX12HTTHIF1A
SCHEMBL29940754 0.75 ALDH1A1 (0.41) ALDH1A1GAAALOX12HTTHIF1A
SCHEMBL2770647 0.75 ALDH1A1 (0.44) ALDH1A1GAAALOX12HTTHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3096735-A1 GRADUAL HAIRCOLOR COMPOSITIONS AND METHODS OF USING THE SAME Combe International Ltd. (US) 2016-11-30 EP claimed
CN-105916482-A Gradual hair color compositions and methods of use thereof 酷姆国际公司 2016-08-31 CN claimed
WO-2015112789-A1 GRADUAL HAIRCOLOR COMPOSITIONS AND METHODS OF USING THE SAME COMBE INTERNATIONAL LTD. (US) 2015-07-30 WO claimed
US-11701308-B2 Compositions for coloring hair including ultra-efficient high aqueous, multi-lamellar emulsion systems, and methods of making the same COMBE INCORPORATED (US) 2023-07-18 US disclosed
EP-4117609-A1 COMPOSITIONS FOR COLORING HAIR INCLUDING ULTRA-EFFICIENT HIGH AQUEOUS, MULTI-LAMELLAR EMULSION SYSTEMS, AND METHODS OF MAKING THE SAME Combe International LLC (US) 2023-01-18 EP disclosed
US-20210283024-A1 COMPOSITIONS FOR COLORING HAIR INCLUDING ULTRA-EFFICIENT HIGH AQUEOUS, MULTI-LAMELLAR EMULSION SYSTEMS, AND METHODS OF MAKING THE SAME COMBE INCORPORATED 2021-09-16 US disclosed
WO-2021183716-A1 COMPOSITIONS FOR COLORING HAIR INCLUDING ULTRA-EFFICIENT HIGH AQUEOUS, MULTI-LAMELLAR EMULSION SYSTEMS, AND METHODS OF MAKING THE SAME COMBE INCORPORATED (US) 2021-09-16 WO disclosed
US-10022312-B2 Gradual haircolor compositions and methods of using the same COMBE INCORPORATED (US) 2018-07-17 US disclosed
US-20170000708-A1 GRADUAL HAIRCOLOR COMPOSITIONS AND METHODS OF USING THE SAME JPMORGAN CHASE BANK, N.A., AS ADMINISTRATIVE AGENT 2017-01-05 US disclosed
EP-3096735-A1 GRADUAL HAIRCOLOR COMPOSITIONS AND METHODS OF USING THE SAME Combe International Ltd. (US) 2016-11-30 EP disclosed
US-9474704-B2 Gradual haircolor compositions and methods of using the same COMBE INCORPORATED (US) 2016-10-25 US disclosed
CN-105916482-A Gradual hair color compositions and methods of use thereof 酷姆国际公司 2016-08-31 CN disclosed
US-20160120780-A1 GRADUAL HAIRCOLOR COMPOSITIONS AND METHODS OF USING THE SAME JPMORGAN CHASE BANK, N.A., AS ADMINISTRATIVE AGENT 2016-05-05 US disclosed
US-9237993-B2 Gradual haircolor compositions and methods of using the same COMBE INCORPORATED (US) 2016-01-19 US disclosed
US-20150209250-A1 GRADUAL HAIRCOLOR COMPOSITIONS AND METHODS OF USING THE SAME JPMORGAN CHASE BANK, N.A., AS ADMINISTRATIVE AGENT 2015-07-30 US disclosed
WO-2015112787-A1 COMPOSITIONS FOR COLORING HAIR INCLUDING MULTI-LAMELLAR EMULSION SYSTEMS AND METHODS OF MAKING THE SAME COMBE INTERNATIONAL LTD. (US) 2015-07-30 WO disclosed
WO-2015112789-A1 GRADUAL HAIRCOLOR COMPOSITIONS AND METHODS OF USING THE SAME COMBE INTERNATIONAL LTD. (US) 2015-07-30 WO disclosed