SCHEMBL24908688

SCHEMBL24908688

CC(C)(C)NC(=O)C(Cc1cccnc1)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(Cc1cccnc1)C(=O)NC(C)(C)C)C5=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
MAPT P10636 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPK1 P28482 1/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
TSHR P16473 1/20 0.38
TP53 P04637 1/20 0.38
CCR9 P51686 1/20 0.37
KDM4E B2RXH2 1/20 0.36
THRB P10828 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
ALOX12 P18054 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MMP13 P45452 1/20 0.35

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
SCHEMBL24908693 0.90 MAPT (0.43) ALDH1A1MAPTSMN1; SMN2LMNAHTT
SCHEMBL24908993 0.88 MAPT (0.46) ALDH1A1MAPTRAB9AMAPK1TSHR
SCHEMBL24909157 0.81 ALOX15 (0.44) ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1
SCHEMBL24705072 0.81 ALDH1A1 (0.53) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL24908987 0.80 MAPT (0.55) ALDH1A1MAPTTP53THRBMEN1
SCHEMBL24909185 0.77 KMT2A (0.48) ALDH1A1MAPTSMN1; SMN2LMNAHTT
SCHEMBL24908684 0.77 MAPT (0.44) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL24909059 0.76 ALDH1A1 (0.40) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL24908968 0.75 RAF1 (0.39) ALDH1A1MAPTSMN1; SMN2MAPK1LMNA
SCHEMBL24909637 0.73 DNMT1 (0.44) ALDH1A1MAPTSMN1; SMN2MAPK1TP53

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