SCHEMBL24908670

SCHEMBL24908670

CC(C)C(C(=O)NCc1cccc2c1oc1ccccc12)N1C(=O)c2cc(Oc3ccccc3)c3c4c(Oc5ccccc5)cc5c6c(cc(Oc7ccccc7)c(c7c(Oc8ccccc8)cc(c2c37)C1=O)c64)C(=O)N(C(C(=O)NCc1cccc2c1oc1ccccc12)C(C)C)C5=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.40
PTGS2 P35354 1/20 0.38
KMT2A Q03164 1/20 0.37
HTT P42858 1/20 0.36
TP53 P04637 2/20 0.36
KDM4E B2RXH2 2/20 0.36
TSHR P16473 2/20 0.34
LMNA P02545 2/20 0.34
POLB P06746 1/20 0.34
EDNRB P24530 2/20 0.34
HPGD P15428 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
MAPT P10636 1/20 0.33
ALOX5 P09917 1/20 0.33

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
SCHEMBL24908999 0.81 HDAC8 (0.36) HDAC8PTGS2KMT2AHTTTP53
SCHEMBL24908950 0.79 LMNA (0.44) TP53LMNASMN1; SMN2CARM1PRMT6
SCHEMBL24739733 0.77 EDNRB (0.33) HDAC8KDM4EEDNRBMAPT
SCHEMBL24909099 0.75 MAPT (0.36) PTGS2KMT2AHTTKDM4ELMNA
SCHEMBL24705245 0.75 EDNRB (0.33) HDAC8KMT2AKDM4EEDNRBALDH1A1
SCHEMBL24739616 0.74 LMNA (0.46) TP53KDM4ETSHRLMNAALDH1A1
SCHEMBL24908980 0.73 PTGS2 (0.36) HDAC8PTGS2KMT2AHTTTP53
SCHEMBL24908947 0.70 LMNA (0.45) KMT2AHTTTP53TSHRLMNA
SCHEMBL24908681 0.69 TP53 (0.42) KMT2ATP53KDM4ETSHRLMNA
SCHEMBL24908678 0.69 SMN1; SMN2 (0.44) KMT2ATP53TSHRLMNASMN1; SMN2

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