SCHEMBL6764355

SCHEMBL6764355

COc1cc(C(=O)O)c(-n2c3ccccc3c3ccccc32)cc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
MYC P01106 3/20 0.55
KDM4E B2RXH2 3/20 0.53
HPGD P15428 3/20 0.53
HSD17B10 Q99714 2/20 0.48
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
CDC25B P30305 2/20 0.43
HTT P42858 1/20 0.42
PTGER4 P35408 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
ALOX15 P16050 1/20 0.41
PDE10A Q9Y233 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RCE1 Q9Y256 1/20 0.41

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
SCHEMBL14657482 0.86 ALDH1A1 (0.73) ALDH1A1MYCKDM4EHPGDHSD17B10
SCHEMBL29453527 0.81 ALDH1A1 (0.71) ALDH1A1MYCKDM4EHPGDHSD17B10
SCHEMBL14656781 0.81 ALDH1A1 (0.61) ALDH1A1MYCKDM4EHSD17B10MEN1
SCHEMBL19680952 0.80 ALDH1A1 (0.73) ALDH1A1MYCKDM4EHPGDHSD17B10
SCHEMBL2555522 0.77 ALDH1A1 (0.57) ALDH1A1MYCKDM4EMEN1KMT2A
SCHEMBL14666376 0.75 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDHSD17B10HTT
SCHEMBL8965180 0.74 PTGER4 (0.58) ALDH1A1KDM4EHPGDHTTPTGER4
SCHEMBL2830233 0.74 LCK (0.72) ALDH1A1MYCKDM4EHPGDHSD17B10
SCHEMBL2553966 0.73 ALDH1A1 (0.50) ALDH1A1MYCKDM4EMEN1KMT2A
SCHEMBL14657207 0.73 ALDH1A1 (0.55) ALDH1A1MYCKDM4EHPGDPTGER4

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
US-6824892-B2 MAIN CHAIN OF PHENYLENE VINYLENE AND A SIDE CHAIN OF CARBAZOLE AND AN ALIPHATIC ALKYL OR ALKOXY GROUP SAMSUNG SDI CO., LTD. (KR) 2004-11-30 US disclosed
US-20020093005-A1 Electroluminescent polymer having good carrier transport balance and electroluminescent device using the same SAMSUNG SDI CO., LTD. 2002-07-18 US disclosed