SCHEMBL22966366

SCHEMBL22966366

O=C=Nc1ccc(Oc2ccc(P(=O)(c3ccccc3)c3ccc(Oc4ccc(N=C=O)cc4)cc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
TSHR P16473 2/20 0.39
CYP3A4 P08684 1/20 0.39
LMNA P02545 1/20 0.38
MMP2 P08253 1/20 0.37
MMP8 P22894 1/20 0.37
MMP14 P50281 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
PGR P06401 2/20 0.36
LTA4H P09960 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MIF P14174 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 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
SCHEMBL25873069 0.90 MAPT (0.37) MAPTTSHRCYP3A4LMNAMMP2
SCHEMBL9184754 0.89 CYP3A4 (0.47) MAPTTSHRCYP3A4LMNAMEN1
SCHEMBL22966342 0.86 MAPT (0.39) MAPTTSHRMMP2MMP8MMP14
SCHEMBL242048 0.86 LTA4H (0.50) TSHRCYP3A4MMP2MMP8CA9
SCHEMBL25873066 0.84 MAPT (0.39) MAPTTSHRCYP3A4LMNAMEN1
SCHEMBL29177739 0.84 LTA4H (0.50) TSHRLMNAMMP2MMP8MMP14
SCHEMBL10798101 0.82 LTA4H (0.55) TSHRLMNAMMP2MMP8MMP14
SCHEMBL50333 0.82 CYP3A4 (0.54) MAPTTSHRCYP3A4MEN1KMT2A
SCHEMBL4551613 0.82 CYP3A4 (0.54) MAPTTSHRCYP3A4MEN1KMT2A
SCHEMBL4544188 0.82 CYP3A4 (0.54) MAPTTSHRCYP3A4MEN1KMT2A

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-20240016699-A1 PHARMACEUTICAL PACKAGES WITH COATINGS COMPRISING POLYCYANURATES CORNING INC (US) 2024-01-18 US disclosed
US-11707411-B2 Pharmaceutical packages with coatings comprising polycyanurates CORNING INCORPORATED (US) 2023-07-25 US disclosed
US-20210038474-A1 PHARMACEUTICAL PACKAGES WITH COATINGS COMPRISING POLYCYANURATES CORNING INCORPORATED 2021-02-11 US disclosed