SCHEMBL931010

SCHEMBL931010

CC/C(O)=C(\C)OC(=O)CC1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 2/20 0.34
EPHX1 P07099 1/20 0.34
HPGD P15428 1/20 0.34
POLB P06746 2/20 0.34
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL4644416 0.79 ALDH1A1 (0.40) L3MBTL1ALDH1A1LMNAKMT2AEPHX1
SCHEMBL10643879 0.78 KMT2A (0.45) L3MBTL1ALDH1A1LMNAKMT2AEPHX1
SCHEMBL6851888 0.77 EPHX1 (0.42) L3MBTL1ALDH1A1LMNAKMT2AEPHX1
SCHEMBL6321838 0.76 EPHX1 (0.48) L3MBTL1ALDH1A1LMNAKMT2AEPHX1
SCHEMBL28053509 0.74 ALDH1A1 (0.38) L3MBTL1ALDH1A1LMNAKMT2AEPHX1
Acetic Acid SCHEMBL17748838 0.73 TDP1 (0.47) L3MBTL1ALDH1A1LMNAKMT2APOLB
SCHEMBL28053510 0.72 NAAA (0.38) L3MBTL1ALDH1A1LMNAKMT2AEPHX1
SCHEMBL4646054 0.71 L3MBTL1 (0.35) L3MBTL1ALDH1A1KMT2AEPHX1HPGD
SCHEMBL28318200 0.71 SOAT1 (0.48) L3MBTL1ALDH1A1LMNAKMT2AEPHX1
SCHEMBL4644409 0.71 KMT2A (0.39) L3MBTL1ALDH1A1LMNAKMT2AEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2448549-A2 COSMETIC USE OF A JASMONIC ACID DERIVATIVE FOR TREATING THE HAIR AND THE SCALP L'Oréal (FR) 2012-05-09 EP claimed
WO-2011000903-A2 COSMETIC USE OF A JASMONIC ACID DERIVATIVE FOR TREATING THE HAIR AND THE SCALP L'OREAL (FR) 2011-01-06 WO claimed
EP-2448549-A2 COSMETIC USE OF A JASMONIC ACID DERIVATIVE FOR TREATING THE HAIR AND THE SCALP L'Oréal (FR) 2012-05-09 EP disclosed
WO-2011000903-A2 COSMETIC USE OF A JASMONIC ACID DERIVATIVE FOR TREATING THE HAIR AND THE SCALP L'OREAL (FR) 2011-01-06 WO disclosed