SCHEMBL24909028

SCHEMBL24909028

CCOCC(C(=O)Oc1ccccc1C)N1C(=O)c2cc(Oc3ccc(C(C)C)cc3)c3c4c(Oc5ccc(C(C)C)cc5)cc5c6c(cc(Oc7ccc(C(C)C)cc7)c(c7c(Oc8ccc(C(C)C)cc8)cc(c2c37)C1=O)c64)C(=O)N(C(COCC)C(=O)Oc1ccccc1C)C5=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 3/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PTGS2 P35354 2/20 0.33
MMP14 P50281 1/20 0.33
MAPT P10636 2/20 0.32
XBP1 P17861 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPBWR1 P48145 1/20 0.32
GAA P10253 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL24909203 0.79 ALDH1A1 (0.40) ALDH1A1KMT2APOLBHPGDKDM4E
SCHEMBL24909057 0.78 KMT2A (0.48) ALDH1A1KMT2APOLBHPGDKDM4E
SCHEMBL24704734 0.74 ALDH1A1 (0.32) ALDH1A1KMT2ATDP1MAPTLMNA
SCHEMBL24909255 0.73 KMT2A (0.34) ALDH1A1KMT2APOLBHPGDKDM4E
SCHEMBL24908976 0.73 MAPT (0.43) ALDH1A1KMT2AKDM4EL3MBTL1MAPT
SCHEMBL24909217 0.72 POLB (0.35) ALDH1A1KMT2APOLBHPGDKDM4E
SCHEMBL24908734 0.72 TSHR (0.46) ALDH1A1KMT2APOLBL3MBTL1MAPT
SCHEMBL24704964 0.72 ALDH1A1 (0.33) ALDH1A1KMT2APOLBKDM4ETDP1
SCHEMBL24909601 0.71 KMT2A (0.47) ALDH1A1KMT2APOLBTDP1MAPT
SCHEMBL24705099 0.70 ALDH1A1 (0.60) ALDH1A1KMT2APOLBL3MBTL1MAPT

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-20230023648-A1 COMPOUND, PHOTOSENSITIVE FLUORESCENT RESIN COMPOSITION COMPRISING SAME, COLOR CONVERSION FILM PREPARED USING SAME, BACKLIGHT UNIT, AND DISPLAY DEVICE LG CHEM, LTD (KR) 2023-01-26 US disclosed