SCHEMBL24909306

SCHEMBL24909306

CC(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)C)cc5)c5c6c(Oc7ccc(C(C)C)cc7)cc7c8c(cc(Oc9ccc(C(C)C)cc9)c(c2c45)c86)C(=O)N(C(C(=O)OC(C(F)(F)F)C(F)(F)F)c2ccc4c(c2)oc2ccccc24)C7=O)C(=O)N(C(C(=O)OC(C(F)(F)F)C(F)(F)F)c2ccc4c(c2)oc2ccccc24)C3=O)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.33
AR P10275 1/20 0.31
TNKS O95271 1/20 0.31
PARP1 P09874 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
PARP2 Q9UGN5 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAOA P21397 1/20 0.31
CYP2C9 P11712 1/20 0.30
NQO1 P15559 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
SCHEMBL24704962 0.80 KDM4E (0.33) MCL1KDM4EALDH1A1GLAHPGD
SCHEMBL24705843 0.80 HTR1A (0.34) KDM4EALDH1A1GLAHPGDSMN1; SMN2
SCHEMBL24705842 0.77 MCL1 (0.30) MCL1
SCHEMBL24705295 0.76 GRM2 (0.32) KDM4EALDH1A1GLAHPGD
SCHEMBL24908724 0.76 ALDH1A1 (0.33) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL24705575 0.76 LMNA (0.33) KDM4EALDH1A1GLAHPGDNPC1
SCHEMBL24908948 0.74 TNF (0.31)
SCHEMBL24908725 0.74 CYP2D6 (0.35) KDM4EALDH1A1GLAHPGDNPC1
SCHEMBL24908980 0.73 PTGS2 (0.36) HDAC6KDM4EALDH1A1HPGDMEN1
SCHEMBL24909093 0.73 ABHD6 (0.38) HCRTR1

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