SCHEMBL22192207

SCHEMBL22192207

O=C(Nc1ccc(Oc2ccc3cc(O)ccc3c2)cc1)c1ccc(Oc2ccc3cc(O)ccc3c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.58
DEGS1 O15121 1/20 0.57
AR P10275 1/20 0.56
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
CRHBP P24387 1/20 0.53
CRHR2 Q13324 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
NPC1 O15118 1/20 0.53
TP53 P04637 1/20 0.53
ALOX15 P16050 1/20 0.53
RAB9A P51151 1/20 0.53
SNCA P37840 1/20 0.53
PLAU P00749 1/20 0.52
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
HDAC3 O15379 1/20 0.51

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
SCHEMBL22192238 0.86 MEN1 (0.70) PGRDEGS1MEN1KMT2AL3MBTL1
SCHEMBL22192240 0.85 PGR (0.72) PGRARMEN1KMT2ASMN1; SMN2
SCHEMBL22192687 0.85 PGR (0.67) PGRARCRHBPCRHR2SMN1; SMN2
SCHEMBL22192227 0.85 NR1H4 (0.63) PGRMEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL22192208 0.82 PTPN11 (0.65) PGRMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL6408301 0.82 MEN1 (0.68) PGRDEGS1MEN1KMT2AL3MBTL1
SCHEMBL15031541 0.81 NPC1 (0.76) DEGS1ARMEN1KMT2ASMN1; SMN2
SCHEMBL2381768 0.81 NPC1 (0.76) MEN1KMT2ASMN1; SMN2NPC1TP53
SCHEMBL22192681 0.80 PGR (0.52) PGRMEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL7064726 0.80 DEGS1 (0.77) DEGS1MEN1KMT2ANPC1RAB9A

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-10703911-B2 Organic colorant, coloring composition, and inkjet ink RICOH COMPANY, LTD. (JP) 2020-07-07 US disclosed