SCHEMBL2226672

SCHEMBL2226672

CCCCCCCCOC(=O)/C=C/c1cccc(OC)c1OC

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.60
KDM4E B2RXH2 3/20 0.59
ALDH1A1 P00352 3/20 0.59
L3MBTL1 Q9Y468 1/20 0.57
HPGD P15428 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
PPARG P37231 1/20 0.53
PPARA Q07869 1/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
MAPK1 P28482 1/20 0.52
APP P05067 3/20 0.50
CYP1A1 P04798 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
ALOX5 P09917 1/20 0.50
TRPM8 Q7Z2W7 1/20 0.50

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
SCHEMBL466048 0.90 KDM4E (0.71) NFE2L2KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL8872479 0.90 KDM4E (0.71) NFE2L2KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL8872224 0.90 KDM4E (0.71) NFE2L2KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL4629237 0.90 KDM4E (0.71) NFE2L2KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL4421062 0.90 KDM4E (0.71) NFE2L2KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL29069534 0.89 ABCG2 (0.54) KDM4EALDH1A1HPGDSMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL10437236 0.89 KDM4E (0.73) NFE2L2KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL5177689 0.89 KDM4E (0.73) NFE2L2KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL30242804 0.88 APP (0.50) NFE2L2KDM4EALDH1A1L3MBTL1HPGD
SCHEMBL6926347 0.87 NFE2L2 (0.59) NFE2L2KDM4EALDH1A1L3MBTL1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011089571-A2 A COSMETIC COMPOSITION INCLUDING AT LEAST ONE FLUOROPHORE COMPOUND L'OREAL (FR) 2011-07-28 WO disclosed
US-6177068-B1 Vinyl amide polymer delivery system for hair and skin treating compositions ISP INVESTMENTS INC. 2001-01-23 US disclosed