SCHEMBL24908736

SCHEMBL24908736

CCCN(C)C(=O)C(Cc1cc2ccccc2[nH]1)N1C(=O)c2cc(Oc3ccc(C(C)C)cc3)c3c4c(Oc5ccc(C(C)C)cc5)cc5c6c(cc(Oc7ccc(C(C)C)cc7)c(c7c(Oc8ccc(C(C)C)cc8)cc(c2c37)C1=O)c64)C(=O)N(C(Cc1cc2ccccc2[nH]1)C(=O)N(C)CCC)C5=O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
DRD2 P14416 3/20 0.33
DRD3 P35462 3/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
DNMT1 P26358 2/20 0.31
KDM4E B2RXH2 2/20 0.31
CYP2C19 P33261 1/20 0.31
DNMT3B Q9UBC3 1/20 0.31
RAD52 P43351 1/20 0.31
UBE2N P61088 1/20 0.31
PKM P14618 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
AADAT Q8N5Z0 1/20 0.30
GAA P10253 1/20 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
SCHEMBL24908761 0.90 TSHR (0.38) TSHRDRD2DRD3KMT2APOLB
SCHEMBL24908734 0.89 TSHR (0.46) TSHRKMT2APOLBMAPTNPSR1
SCHEMBL24909182 0.86 TSHR (0.39) TSHRKMT2APOLBMAPTNPSR1
SCHEMBL24909183 0.83 GAA (0.39) TSHRKMT2APOLBMAPTNPSR1
SCHEMBL24908760 0.82 TSHR (0.39) TSHRDRD2DRD3KMT2APOLB
SCHEMBL24909635 0.79 KMT2A (0.35) TSHRKMT2APOLBMAPTNPSR1
SCHEMBL24909072 0.77 POLB (0.34) TSHRKMT2APOLBMAPTNPSR1
SCHEMBL24909330 0.77 CCKBR (0.37) TSHRDRD3KMT2APOLBNPSR1
SCHEMBL24909046 0.77 TSHR (0.35) TSHRKMT2APOLBNPSR1KDM4E
SCHEMBL24908692 0.75 POLB (0.42) TSHRKMT2APOLBMAPTNPSR1

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