SCHEMBL6944962

SCHEMBL6944962

COc1ccc(C(CCl)C(=O)C(CCl)c2ccc(OC)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.48
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
AKR1C3 P42330 3/20 0.47
AKR1C2 P52895 3/20 0.47
AKR1C1 Q04828 1/20 0.47
PTGS1 P23219 1/20 0.47
LDHA P00338 1/20 0.44
CNR2 P34972 2/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MEN1 O00255 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL6289375 0.86 CA1 (0.47) L3MBTL1ALDH1A1TSHRMAPK1TDP1
SCHEMBL11550990 0.86 L3MBTL1 (0.46) L3MBTL1ALDH1A1TSHRMAPK1TDP1
SCHEMBL10386264 0.85 AKR1C3 (0.68) L3MBTL1TSHRTDP1AKR1C3AKR1C2
SCHEMBL28277043 0.81 GSK3B (0.50) L3MBTL1ALDH1A1TSHRMAPK1TDP1
SCHEMBL27767245 0.81 AKR1C3 (0.47) L3MBTL1ALDH1A1TSHRMAPK1TDP1
SCHEMBL28199207 0.81 HDAC3 (0.50) L3MBTL1ALDH1A1TSHRMAPK1TDP1
SCHEMBL7348796 0.80 AKR1C3 (0.54) L3MBTL1ALDH1A1TSHRMAPK1TDP1
SCHEMBL27639581 0.80 LDHA (0.61) LDHAHTT
SCHEMBL27633580 0.79 SRD5A2 (0.50) RAB9AHPGD
SCHEMBL11754467 0.79 ALDH1A1 (0.50) L3MBTL1ALDH1A1CNR2CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109180515-A A kind of synthetic method of N- [2- hydroxyl -2- (4- methoxyphenyl) ethyl] cinnamamide 苏利制药科技江阴有限公司 2019-01-11 CN disclosed
US-6664111-B2 The detector is a solid polymeric matrix, e.g., siloxane, modified by a luminescent platinum group metal phenanthroline chelate complex which is quenchable by oxygen; blood and tissue samples; medical diagnosis; compact; lightweight 3M INNOVATIVE PROPERTIES COMPANY 2003-12-16 US disclosed
US-20030099574-A1 Fluorescence based oxygen sensor systems 3M INNOVATIVE PROPERTIES COMPANY 2003-05-29 US disclosed