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SCHEMBL24909324

SCHEMBL24909324

CCN1CCN(C(=O)C(C(C)C)N2C(=O)c3cc(Oc4cccc(C(C)C)c4)c4c5c(Oc6cccc(C(C)C)c6)cc6c7c(cc(Oc8cccc(C(C)C)c8)c(c8c(Oc9cccc(C(C)C)c9)cc(c3c48)C2=O)c75)C(=O)N(C(C(=O)N2CCN(CC)CC2)C(C)C)C6=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.41
▸ CHRM1 P11229 2/20 0.37
▸ GHSR Q92847 4/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ POLB P06746 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ KMT2A Q03164 5/20 0.34
▸ MEN1 O00255 4/20 0.34
▸ HTT P42858 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 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
SCHEMBL24705345 0.84 ALDH1A1 (0.36) ALDH1A1GHSRGAAPOLBRXFP1
SCHEMBL24908755 0.75 KDM4E (0.37) ALDH1A1KDM4ELMNA
SCHEMBL24705069 0.74 MEN1 (0.34) GHSRGAAPOLBRXFP1KMT2A
SCHEMBL24909623 0.72 SMN1; SMN2 (0.44) ALDH1A1GHSRKMT2AMEN1HTT
SCHEMBL24704939 0.71 ALDH1A1 (0.37) ALDH1A1GHSRPOLBRXFP1KMT2A
SCHEMBL24909621 0.70 PTGES (0.39) ALDH1A1GHSRKDM4EGAAPOLB
SCHEMBL24908766 0.70 PTGES (0.39) ALDH1A1GHSRKDM4EGAAPOLB
SCHEMBL24909601 0.68 KMT2A (0.47) ALDH1A1GAAPOLBKMT2AMEN1
SCHEMBL24909204 0.67 NPC1 (0.46) ALDH1A1KDM4EGAAPOLBRXFP1
SCHEMBL24908715 0.65 DNMT1 (0.39) ALDH1A1TP53

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