SCHEMBL28417243

SCHEMBL28417243

CCCCN1C(=O)c2cccc3c(NC(=O)C4CCCC4)ccc(c23)C1=O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.70
MAPT P10636 4/20 0.70
USP2 O75604 2/20 0.70
LMNA P02545 2/20 0.70
TSHR P16473 1/20 0.70
KMT2A Q03164 3/20 0.61
HTT P42858 3/20 0.61
MEN1 O00255 2/20 0.61
MAPK1 P28482 2/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
NPSR1 Q6W5P4 2/20 0.61
RGS12 O14924 1/20 0.61
POLB P06746 1/20 0.61
ATM Q13315 1/20 0.61
TLR9 Q9NR96 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
HDAC1 Q13547 4/20 0.53
HDAC6 Q9UBN7 4/20 0.53
HDAC3 O15379 3/20 0.52
HDAC11 Q96DB2 3/20 0.52

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
SCHEMBL28886288 0.96 MAPT (0.64) ALDH1A1MAPTUSP2LMNATSHR
SCHEMBL3130487 0.83 MAPT (0.70) ALDH1A1MAPTUSP2LMNATSHR
SCHEMBL28420489 0.80 KMT2A (0.69) ALDH1A1MAPTUSP2LMNATSHR
SCHEMBL28420416 0.79 MAPT (0.67) ALDH1A1MAPTUSP2LMNAKMT2A
SCHEMBL19342781 0.78 KMT2A (0.77) ALDH1A1MAPTUSP2LMNAKMT2A
SCHEMBL27339723 0.78 MAPT (0.57) ALDH1A1MAPTUSP2LMNATSHR
SCHEMBL27864563 0.77 KMT2A (0.75) ALDH1A1MAPTUSP2LMNAKMT2A
SCHEMBL18738332 0.77 KMT2A (0.67) ALDH1A1MAPTUSP2LMNAKMT2A
SCHEMBL19293596 0.76 MAPT (0.60) ALDH1A1MAPTUSP2LMNATSHR
SCHEMBL9437176 0.76 ALDH1A1 (0.64) ALDH1A1MAPTUSP2LMNATSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111334078-B 405nm excited high-brightness and high-stability fluorescent dye and synthetic method thereof 中国科学院大连化学物理研究所 2021-12-21 CN disclosed
CN-111334078-A 405nm excited high-brightness and high-stability fluorescent dye and synthetic method thereof 中国科学院大连化学物理研究所 2020-06-26 CN disclosed
CN-111334079-A Full-spectrum high-brightness and high-stability fluorescent dye and synthesis and application thereof 中国科学院大连化学物理研究所 2020-06-26 CN disclosed