SCHEMBL24909302

SCHEMBL24909302

Cc1cc(C(C)C)ccc1Oc1cc2c3c(cc(Oc4ccc(C(C)C)cc4C)c4c5c(Oc6ccc(C(C)C)cc6C)cc6c7c(cc(Oc8ccc(C(C)C)cc8C)c(c1c34)c75)C(=O)N(C(Cc1cccc3c1oc1ccccc13)C(=O)Oc1ccccc1)C6=O)C(=O)N(C(Cc1cccc3c1oc1ccccc13)C(=O)Oc1ccccc1)C2=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
GLA P06280 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 3/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
DNMT1 P26358 2/20 0.32
CYP2C19 P33261 2/20 0.32
DNMT3B Q9UBC3 1/20 0.32
PKM P14618 1/20 0.32
EDNRB P24530 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
ALOX5 P09917 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
SCHEMBL24909060 0.93 HPGD (0.34) HDAC8KDM4EALDH1A1GLAHPGD
SCHEMBL24909078 0.86 HDAC8 (0.36) HDAC8KDM4EALDH1A1GLAHPGD
SCHEMBL24908944 0.83 KDM4E (0.36) HDAC8KDM4EALDH1A1GLAHPGD
SCHEMBL24909187 0.79 SMN1; SMN2 (0.42) KDM4EALDH1A1HPGDKMT2APOLB
SCHEMBL24704947 0.76 HDAC8 (0.34) HDAC8KDM4EALDH1A1GLAHPGD
SCHEMBL24908750 0.76 TNF (0.32) KMT2APOLBMAPTSMN1; SMN2MEN1
SCHEMBL24705423 0.74 EDNRB (0.33) HDAC8KMT2ADNMT1CYP2C19DNMT3B
SCHEMBL24909057 0.74 KMT2A (0.48) KDM4EALDH1A1HPGDKMT2APOLB
SCHEMBL24908672 0.73 ALDH1A1 (0.32) ALDH1A1
SCHEMBL24908955 0.72 TNF (0.35) KMT2AMAPTSMN1; SMN2MEN1

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 2 patents. 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
US-9624160-B2 Reactive ionic liquids BASF SE (DE) 2017-04-18 US disclosed