SCHEMBL7754480

SCHEMBL7754480

CCCCCCCCCCCCCCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.78

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCL9 O00512 1/20 0.78
CTNNB1 P35222 1/20 0.78
MGLL Q99685 2/20 0.65
ALDH1A1 P00352 3/20 0.54
KMT2A Q03164 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MAPT P10636 3/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
GAA P10253 1/20 0.51
TDP1 Q9NUW8 2/20 0.51
PTPN7 P35236 1/20 0.48
PTPN12 Q05209 1/20 0.48
PTPN22 Q9Y2R2 1/20 0.48
EGFR P00533 1/20 0.47
ERBB2 P04626 1/20 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
SCHEMBL136672 1.00 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A
SCHEMBL13184389 1.00 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A
SCHEMBL131963 1.00 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A
SCHEMBL1170899 1.00 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A
SCHEMBL1916980 1.00 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A
SCHEMBL22531036 1.00 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A
SCHEMBL7191252 1.00 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A
SCHEMBL135634 1.00 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A
SCHEMBL8388580 1.00 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A
SCHEMBL8822087 1.00 BCL9 (0.78) BCL9CTNNB1MGLLALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1084623-C Novel pharmaceutical compositions KIRIN BREWERY (JP) 2002-05-15 CN disclosed
EP-0650732-B1 NOVEL MEDICINAL COMPOSITION KIRIN BREWERY (JP) 2001-04-04 EP disclosed
US-6071884-A ADMINISTERING TO THE PATIENT ATLEAST ONE ALPHA-GALACTOSYLCERAMIDE TO TREAT THROMBOCYTOPENIA KIRIN BEER KABUSHIKI KAISHA (JP) 2000-06-06 US disclosed
US-6017892-A Method for accelerating marrow cell proliferation KIRAN BEER KABUSHIKI KAISHA (JP) 2000-01-25 US disclosed
US-5936076-A ANTITUMOR/ANTICARCINOGENIC AGENTS; IMMUNOSTIMULATORS; THERAPY AGAINST INFECTIONS, AQUIRED IMMUNE DEFICIENCY SYNDROME KIRIN BEER KABUSHIKI KAISHA (JP) 1999-08-10 US disclosed
EP-0609437-B1 NOVEL SPHINGOGLYCOLIPID AND USE THEREOF KIRIN BREWERY (JP) 1999-07-07 EP disclosed
US-5767092-A Treatment of radiation-damaged bone marrow using galactosyl ceramides KIRIN BEER KABUSHIKI KAISHA (JP) 1998-06-16 US disclosed
EP-0650732-A1 NOVEL MEDICINAL COMPOSITION KIRIN BEER KABUSHIKI KAISHA (JP) 1995-05-03 EP disclosed
EP-0609437-A1 NOVEL SPHINGOGLYCOLIPID AND USE THEREOF KIRIN BEER KABUSHIKI KAISHA (JP) 1994-08-10 EP disclosed
CN-1088093-A new pharmaceutical composition KIRIN BREWERY (JP) 1994-06-22 CN disclosed