SCHEMBL24909059

SCHEMBL24909059

CC(C)C(C(=O)Oc1cccnc1)N1C(=O)c2cc(Oc3ccc(C(C)(C)C)cc3)c3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c6c(cc(Oc7ccc(C(C)(C)C)cc7)c(c7c(Oc8ccc(C(C)(C)C)cc8)cc(c2c37)C1=O)c64)C(=O)N(C(C(=O)Oc1cccnc1)C(C)C)C5=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
RAB9A P51151 4/20 0.36
MAPK1 P28482 3/20 0.36
GALR3 O60755 1/20 0.36
ICAM1 P05362 1/20 0.33
SELE P16581 1/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
NPC1 O15118 3/20 0.33
MAPT P10636 2/20 0.33
CCR9 P51686 1/20 0.32
ALOX15 P16050 1/20 0.32
XDH P47989 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
NAMPT P43490 1/20 0.31
CCNC P24863 1/20 0.31

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
SCHEMBL24909308 0.89 L3MBTL1 (0.39) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL24909038 0.89 MAPT (0.34) ALDH1A1SMN1; SMN2RAB9AICAM1SELE
SCHEMBL24908680 0.84 MAPT (0.33) ALDH1A1MAPK1KMT2AKDM4EMEN1
SCHEMBL24908715 0.81 DNMT1 (0.39) ALDH1A1SMN1; SMN2ICAM1SELE
SCHEMBL24909333 0.79 DNMT1 (0.31) ALDH1A1ICAM1SELE
SCHEMBL24909227 0.79 TP53 (0.44) ALDH1A1SMN1; SMN2MAPK1KMT2AKDM4E
SCHEMBL24908667 0.77 TP53 (0.48) ALDH1A1SMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL24908754 0.76 NPSR1 (0.37) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL24909623 0.76 SMN1; SMN2 (0.44) ALDH1A1SMN1; SMN2RAB9AKMT2AMEN1
SCHEMBL24909622 0.76 DNMT1 (0.33) ALDH1A1SMN1; SMN2ICAM1SELEMAPT

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