SCHEMBL8934944

SCHEMBL8934944

CC(=O)Oc1cc2cc[nH]c2cc1O.CCOC(=O)c1cc2cc(O)ccc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.51
ALDH1A1 P00352 3/20 0.51
HPGD P15428 3/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HSD17B10 Q99714 1/20 0.51
MMP13 P45452 7/20 0.48
NPC1 O15118 2/20 0.48
LMNA P02545 2/20 0.48
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
MMP2 P08253 5/20 0.47
MMP14 P50281 3/20 0.45
MEN1 O00255 1/20 0.45
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
ATM Q13315 1/20 0.45

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
SCHEMBL829213 0.80 KDM4E (0.76) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL1702125 0.78 BACE1 (0.42) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL8609809 0.76 NPSR1 (0.41) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL9279869 0.75 GPR35 (0.48) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL5680973 0.74 KDM4E (0.76) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL4907791 0.73 ALOX15 (0.72) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL9442085 0.73 BACE1 (0.42) KDM4EALDH1A1HPGDRAB9AHSD17B10
SCHEMBL9279863 0.73 GPR35 (0.48) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
Indole SCHEMBL29130809 0.73 KDM4E (0.65) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL25721601 0.72 KDM4E (0.60) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5547658-A Cosmetic composition containing melaninlike pigments in combination with certain tocopherols, and process for protecting the skin, hair, mucosae and cosmetic compositions L'OREAL (FR) 1996-08-20 US claimed