SCHEMBL24909033

SCHEMBL24909033

O=C(C(Cc1ccncc1)N1C(=O)c2cc(Oc3ccc(CCO)cc3)c3c4c(Oc5ccc(CCO)cc5)cc5c6c(cc(Oc7ccc(CCO)cc7)c(c7c(Oc8ccc(CCO)cc8)cc(c2c37)C1=O)c64)C(=O)N(C(Cc1ccncc1)C(=O)N1CCCCC1)C5=O)N1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 5/20 0.35
HPGD P15428 4/20 0.35
GAA P10253 2/20 0.35
POLB P06746 3/20 0.34
LMNA P02545 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
NPSR1 Q6W5P4 3/20 0.33
HTT P42858 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPT P10636 2/20 0.33
MAPK1 P28482 1/20 0.33
THRB P10828 1/20 0.32
HRH3 Q9Y5N1 1/20 0.31
ADAM10 O14672 1/20 0.31
MMP3 P08254 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
SCHEMBL24739946 0.91 TSHR (0.45) TSHRKMT2AMEN1CYP3A4CYP2C19
SCHEMBL24909392 0.80 POLB (0.40) TSHRKMT2AMEN1CYP3A4CYP2C19
SCHEMBL24739789 0.80 KMT2A (0.40) TSHRKMT2AMEN1CYP3A4CYP2C19
SCHEMBL24908710 0.77 POLB (0.37) TSHRKMT2AMEN1ALDH1A1GAA
SCHEMBL24908756 0.76 ALDH1A1 (0.50) TSHRKMT2AMEN1ALDH1A1HPGD
SCHEMBL24909193 0.75 POLB (0.33) TSHRKMT2AALDH1A1POLBMAPT
SCHEMBL24908711 0.75 POLB (0.46) TSHRKMT2AMEN1CYP3A4CYP2C19
SCHEMBL24909125 0.74 TSHR (0.47) TSHRKMT2AMEN1CYP3A4CYP2C19
SCHEMBL12324732 0.74 ALDH1A1 (0.54) TSHRKMT2AMEN1CYP3A4CYP2C19
SCHEMBL24739797 0.73 MCL1 (0.42) KMT2AALDH1A1GAAPOLBL3MBTL1

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