SCHEMBL788922

SCHEMBL788922

CC(C)=CCCC(C)=CCCC(C)=CCOC(=O)O

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.73
ALOX15 P16050 2/20 0.73
FNTA P49354 4/20 0.63
FNTB P49356 4/20 0.63
PGGT1B P53609 1/20 0.59
KMT2A Q03164 2/20 0.57
TRPV1 Q8NER1 2/20 0.56
KDM4E B2RXH2 1/20 0.53
ATM Q13315 1/20 0.53
MAPT P10636 2/20 0.52
MEN1 O00255 1/20 0.52
CYP3A4 P08684 1/20 0.52
UGT1A1 P22309 1/20 0.52

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
SCHEMBL28447214 0.98 ALDH1A1 (0.76) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL7220417 0.98 ALDH1A1 (0.76) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL7220413 0.98 ALDH1A1 (0.76) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL1301763 0.87 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL11404530 0.87 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL1301765 0.87 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL806725 0.87 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL133908 0.87 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL806928 0.87 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL11410939 0.87 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2097059-B1 CLEANSING OR CARE PRODUCT HENKEL KGAA (DE) 2012-04-18 EP disclosed
WO-2012037069-A2 UNIQUE HALOGEN-INDUCED CYCLIZATIONS, REAGENTS THEREFOR, AND COMPOUNDS PRODUCED THEREBY THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-03-22 WO disclosed
EP-2167017-A2 COSMETIC STICK BASED ON A CONGEALED OIL-IN-WATER DISPERSION/EMULSION HAVING A HYDROGEL FORMER Henkel AG & Co. KGaA (DE) 2010-03-31 EP disclosed
EP-2167018-A2 COSMETIC STICK BASED ON A CONGEALED OIL-IN-WATER DISPERSION/EMULSION Henkel AG & Co. KGaA (DE) 2010-03-31 EP disclosed
EP-2011476-A2 Moisture-emitting cosmetic and dermatological compounds with enhancers Henkel AG & Co. KGaA (DE) 2009-01-07 EP disclosed
WO-2008155382-A2 COSMETIC STICK BASED ON A CONGEALED OIL-IN-WATER DISPERSION/EMULSION HAVING A HYDROGEL FORMER HENKEL AG & CO. KGAA (DE) 2008-12-24 WO disclosed
WO-2008155391-A2 COSMETIC STICK BASED ON A CONGEALED OIL-IN-WATER DISPERSION/EMULSION HENKEL AG & CO. KGAA (DE) 2008-12-24 WO disclosed
EP-1994923-A2 Cosmetic and dermatological compositions for dry skin Henkel AG & Co. KGaA (DE) 2008-11-26 EP disclosed
EP-1938783-A2 Deodorant emulsion spray Henkel AG & Co. KGaA (DE) 2008-07-02 EP disclosed
EP-1813310-A2 Cosmetic stick based on an oil in water dispersion/emulsion Henkel Kommanditgesellschaft auf Aktien (DE) 2007-08-01 EP disclosed