SCHEMBL24909005

SCHEMBL24909005

CC(C)CNC(=O)C(CC(F)(F)F)N1C(=O)c2cc(Oc3ccc(C(C)(C)C)cc3)c3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c6c(cc(Oc7ccc(C(C)(C)C)cc7)c(c7c(Oc8ccc(C(C)(C)C)cc8)cc(c2c37)C1=O)c64)C(=O)N(C(CC(F)(F)F)C(=O)NCC(C)C)C5=O

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 3/20 0.35
RAF1 P04049 1/20 0.33
TNF P01375 1/20 0.32
MCL1 Q07820 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NR1H4 Q96RI1 2/20 0.31
EPHX2 P34913 1/20 0.31
TP53 P04637 1/20 0.30
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30
MLYCD O95822 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL24909321 0.82 MAPT (0.40) DNMT1ALDH1A1NPSR1TP53SMN1; SMN2
SCHEMBL24705339 0.82 DNMT1 (0.32) DNMT1HPGDSMN1; SMN2
SCHEMBL24705132 0.81 DNMT1 (0.31) DNMT1
SCHEMBL24908731 0.79 NPC1 (0.37) ALDH1A1HPGDNPSR1NR1H4SMN1; SMN2
SCHEMBL24909006 0.79 SMN1; SMN2 (0.34) TP53SMN1; SMN2
SCHEMBL24908986 0.79 ECE1 (0.36) DNMT1ALDH1A1HPGDSMN1; SMN2
SCHEMBL24705574 0.77 LIPG (0.33) ALDH1A1SMN1; SMN2
SCHEMBL24909637 0.76 DNMT1 (0.44) DNMT1TNFMCL1ALDH1A1HPGD
SCHEMBL24909257 0.75 DNMT1 (0.36) DNMT1TNFALDH1A1HPGDNPSR1
SCHEMBL24705072 0.74 ALDH1A1 (0.53) DNMT1MCL1ALDH1A1

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