Avobenzone

Avobenzone

SCHEMBL4245068

COc1ccc(C(=O)CC(=O)c2ccc(C(C)(C)C)cc2)cc1.Nc1ccccc1C(=O)O

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.69
LMNA P02545 2/20 0.69
HSD17B10 Q99714 2/20 0.69
MAPK1 P28482 2/20 0.69
RECQL P46063 2/20 0.69
ALOX15 P16050 1/20 0.69
APEX1 P27695 1/20 0.69
TDP1 Q9NUW8 1/20 0.69
NPC1 O15118 8/20 0.54
MAPT P10636 4/20 0.52
RAB9A P51151 6/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
EPHX2 P34913 1/20 0.49
NR1H4 Q96RI1 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KDM4E B2RXH2 2/20 0.48
HDAC3 O15379 2/20 0.48
HDAC4 P56524 2/20 0.48

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
Avobenzone SCHEMBL19031191 0.91 ALDH1A1 (0.66) ALDH1A1LMNAHSD17B10MAPK1RECQL
Avobenzone SCHEMBL6129882 0.87 LMNA (0.71) ALDH1A1LMNAHSD17B10MAPK1RECQL
Avobenzone SCHEMBL5680371 0.86 TDP1 (0.88) ALDH1A1LMNAHSD17B10MAPK1RECQL
SCHEMBL312323 0.83 NPC1 (0.71) ALDH1A1LMNAHSD17B10MAPK1RECQL
Avobenzone SCHEMBL1768910 0.83 ALDH1A1 (1.00) ALDH1A1LMNAHSD17B10MAPK1RECQL
Avobenzone SCHEMBL15650 0.83 ALDH1A1 (1.00) ALDH1A1LMNAHSD17B10MAPK1RECQL
Avobenzone SCHEMBL28842232 0.82 ALDH1A1 (0.81) ALDH1A1LMNAHSD17B10MAPK1RECQL
Avobenzone SCHEMBL28576597 0.82 ALDH1A1 (0.81) ALDH1A1LMNAHSD17B10MAPK1RECQL
Avobenzone SCHEMBL16506197 0.82 ALDH1A1 (0.97) ALDH1A1LMNAHSD17B10MAPK1RECQL
SCHEMBL3385712 0.79 NPC1 (0.73) ALDH1A1LMNAHSD17B10MAPK1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1675490-A1 SUBSTRATES AND DEVICES FOR APPLYING A LIP CARE FORMULATION Kimberly-Clark Worldwide, Inc. (US) 2006-07-05 EP claimed
WO-2005041711-A1 SUBSTRATES AND DEVICES FOR APPLYING A LIP CARE FORMULATION KIMBERLY-CLARK WORLDWIDE, INC. (US) 2005-05-12 WO claimed
US-20050066463-A1 Substrates and devices for applying a lip care formulation KIMBERLY-CLARK WORLDWIDE, INC. 2005-03-31 US claimed
US-20090101163-A1 Substrates and devices for applying a lip care formulation BRUNNER MICHAEL S 2009-04-23 US disclosed
EP-1675490-A1 SUBSTRATES AND DEVICES FOR APPLYING A LIP CARE FORMULATION Kimberly-Clark Worldwide, Inc. (US) 2006-07-05 EP disclosed
WO-2005041711-A1 SUBSTRATES AND DEVICES FOR APPLYING A LIP CARE FORMULATION KIMBERLY-CLARK WORLDWIDE, INC. (US) 2005-05-12 WO disclosed
US-20050066463-A1 Substrates and devices for applying a lip care formulation KIMBERLY-CLARK WORLDWIDE, INC. 2005-03-31 US disclosed