SCHEMBL24908972

SCHEMBL24908972

CCN(C(=O)C(Cc1cccnc1)N1C(=O)c2cc(Oc3ccc(C)cc3C)c3c4c(Oc5ccc(C)cc5C)cc5c6c(cc(Oc7ccc(C)cc7C)c(c7c(Oc8ccc(C)cc8C)cc(c2c37)C1=O)c64)C(=O)N(C(Cc1cccnc1)C(=O)N(CC)c1ccncc1)C5=O)c1ccncc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.37
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
TP53 P04637 3/20 0.34
HSD11B1 P28845 1/20 0.32
QPCT Q16769 1/20 0.32
TRPM8 Q7Z2W7 1/20 0.32
KMT2A Q03164 1/20 0.32
PDK1 Q15118 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL24908695 0.87 NPC1 (0.32)
SCHEMBL24909384 0.86 ALDH1A1 (0.43) ALDH1A1TSHRSMN1; SMN2HSD11B1KMT2A
SCHEMBL24908742 0.77 HSD11B1 (0.45) ALDH1A1TSHRSMN1; SMN2HSD11B1KMT2A
SCHEMBL24908973 0.77 HSD11B1 (0.45) ALDH1A1TSHRSMN1; SMN2HSD11B1KMT2A
SCHEMBL24705412 0.77 ALDH1A1 (0.34) ALDH1A1TSHRKDM4EHSD11B1HSD17B10
SCHEMBL24908966 0.75 TRPM8 (0.31) TRPM8
SCHEMBL24908710 0.74 POLB (0.37) ALDH1A1TSHRKMT2ALMNAPOLB
SCHEMBL24909195 0.73 PKM (0.45) ALDH1A1TSHRSMN1; SMN2TP53KMT2A
SCHEMBL24909207 0.73 NOTUM (0.32) ALDH1A1KDM4ESMN1; SMN2TP53KMT2A
SCHEMBL24909307 0.71 POLB (0.54) ALDH1A1HSD11B1KMT2APOLB

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