SCHEMBL24334669

SCHEMBL24334669

O=C1c2ccccc2-c2ccc(-c3ccccc3)c3cccc1c23

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.64
SMN1; SMN2 Q16637 4/20 0.64
PABPC1 P11940 3/20 0.64
KDM4E B2RXH2 2/20 0.64
CYP3A4 P08684 2/20 0.55
DNMT1 P26358 2/20 0.55
CASP1 P29466 2/20 0.55
CASP7 P55210 1/20 0.55
CYP1A2 P05177 3/20 0.53
ALDH1A1 P00352 2/20 0.52
CYP2C9 P11712 1/20 0.52
HBB P68871 1/20 0.52
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
APAF1 O14727 2/20 0.47
LMNA P02545 2/20 0.47
THRB P10828 2/20 0.47
HTT P42858 2/20 0.47

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
SCHEMBL31619722 0.90 MAPT (0.50) MAPTSMN1; SMN2PABPC1KDM4ECYP3A4
SCHEMBL12205418 0.90 MAPT (0.50) MAPTSMN1; SMN2PABPC1KDM4ECYP3A4
SCHEMBL29456701 0.88 PABPC1 (0.72) MAPTSMN1; SMN2PABPC1KDM4ECYP3A4
SCHEMBL13045522 0.88 PABPC1 (0.72) MAPTSMN1; SMN2PABPC1KDM4ECYP3A4
SCHEMBL2033903 0.88 CRHBP (0.56) MAPTSMN1; SMN2PABPC1KDM4ECYP3A4
SCHEMBL31107072 0.88 CRHBP (0.56) MAPTSMN1; SMN2PABPC1KDM4ECYP3A4
SCHEMBL2135924 0.79 TYMS (0.59) MAPTSMN1; SMN2PABPC1KDM4EALDH1A1
SCHEMBL20835013 0.79 MAPT (0.66) MAPTSMN1; SMN2PABPC1KDM4ECYP3A4
SCHEMBL15028262 0.79 MAPT (0.47) MAPTSMN1; SMN2PABPC1KDM4ECYP3A4
SCHEMBL1983882 0.78 PABPC1 (0.64) MAPTSMN1; SMN2PABPC1KDM4ECYP3A4

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-20220123213-A1 LUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2022-04-21 US disclosed