SCHEMBL24909574

SCHEMBL24909574

CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6c(Oc7ccc(C(C)(C)C)cc7)cc7c8c(cc(Oc9ccc(C(C)(C)C)cc9)c(c2c45)c86)C(=O)N(C(CC2CCCC2)C(=O)OC2CCCCC2)C7=O)C(=O)N(C(CC2CCCC2)C(=O)OC2CCCCC2)C3=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPY5R Q15761 1/20 0.31
REN P00797 1/20 0.31
USP2 O75604 1/20 0.31
GHSR Q92847 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
HPGD P15428 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
PDE4A P27815 2/20 0.30
PDE4B Q07343 2/20 0.30
PDE4C Q08493 2/20 0.30

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
SCHEMBL24704946 0.89
SCHEMBL24705096 0.87 DNMT1 (0.34) DNMT1MAPTRAB9AALDH1A1KDM4E
SCHEMBL24909012 0.84 CTSS (0.33) DNMT1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL24705010 0.83 DNMT1 (0.33) DNMT1ALDH1A1KDM4ENPY5R
SCHEMBL24704910 0.82 REN (0.33) DNMT1SMN1; SMN2HTTRAB9AALDH1A1
SCHEMBL24909123 0.80 ALDH1A1 (0.33) DNMT1MAPTALDH1A1KDM4EKMT2A
SCHEMBL24705236 0.80 TP53 (0.33) MAPTALDH1A1KDM4EHPGD
SCHEMBL24909202 0.80 GCK (0.31) REN
SCHEMBL24908707 0.79 ALDH1A1 (0.37) SMN1; SMN2NPC1MAPTRAB9AALDH1A1
SCHEMBL24909119 0.77 GCK (0.32) ALDH1A1KDM4ENPY5RREN

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-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
US-9624160-B2 Reactive ionic liquids BASF SE (DE) 2017-04-18 US disclosed