SCHEMBL22969897

SCHEMBL22969897

CC1(C)c2ccccc2N(c2ccc(N3c4ccccc4C4(c5ccccc5C(=O)c5ccccc54)c4ccccc43)cc2)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PGR P06401 11/20 0.44
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
GAA P10253 2/20 0.39
CES1 P23141 2/20 0.39
CES2 O00748 1/20 0.39
BCHE P06276 1/20 0.39
HTT P42858 2/20 0.36
MAPT P10636 2/20 0.36
NPC1 O15118 1/20 0.36
USP2 O75604 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.35
TTR P02766 1/20 0.34

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
SCHEMBL29357946 0.87 GAA (0.51) PGRMEN1KMT2AALDH1A1NPSR1
SCHEMBL2754776 0.87 GAA (0.51) PGRMEN1KMT2AALDH1A1NPSR1
SCHEMBL21453611 0.86 PGR (0.48) PGRMEN1KMT2AALDH1A1NPSR1
SCHEMBL24569754 0.85 PGR (0.39) PGRMEN1KMT2AALDH1A1NPSR1
SCHEMBL24608648 0.85 PGR (0.37) PGRMEN1KMT2AALDH1A1NPSR1
SCHEMBL2754777 0.85 PGR (0.46) PGRMEN1KMT2AALDH1A1GAA
SCHEMBL24689205 0.84 PGR (0.46) PGRMEN1KMT2AALDH1A1NPSR1
SCHEMBL14681704 0.84 PGR (0.43) PGRMEN1KMT2AALDH1A1NPSR1
SCHEMBL14681633 0.84 PGR (0.43) PGRMEN1KMT2AALDH1A1NPSR1
SCHEMBL19319647 0.84 PGR (0.46) PGRMEN1KMT2AALDH1A1NPSR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11778894-B2 Boron-containing organic light-emitting diode device and preparation method thereof JIANGSU SUNERA TECHNOLOGY CO., LTD. (CN) 2023-10-03 US disclosed
US-11778894-B2 Boron-containing organic light-emitting diode device and preparation method thereof JIANGSU SUNERA TECHNOLOGY CO., LTD. (CN) 2023-10-03 US disclosed
US-20210043841-A1 BORON-CONTAINING ORGANIC LIGHT-EMITTING DIODE DEVICE AND PREPARATION METHOD THEREOF VALIANT CO., LTD. (CN) 2021-02-11 US disclosed