SCHEMBL1799219

SCHEMBL1799219

O=C(O)[C@H](Cc1c[nH]cn1)Nc1cccc([N+](=O)[O-])c1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
ITGB1 P05556 1/20 0.35
ITGA4 P13612 1/20 0.35
ALDH1A1 P00352 5/20 0.35
MEN1 O00255 2/20 0.35
MAPT P10636 2/20 0.35
POLB P06746 2/20 0.35
GAA P10253 2/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GPR35 Q9HC97 1/20 0.35
KDM4E B2RXH2 1/20 0.34
KDM4A O75164 1/20 0.34
PPARG P37231 1/20 0.34
TRPV1 Q8NER1 1/20 0.33
CXCR1 P25024 1/20 0.33
CXCR2 P25025 1/20 0.33
RAB9A P51151 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL1653021 1.00 KMT2A (0.43) KMT2AITGB1ITGA4ALDH1A1MEN1
SCHEMBL7276715 0.81 CRHBP (0.44) KMT2AALDH1A1MEN1MAPTPOLB
SCHEMBL7276719 0.81 CRHBP (0.44) KMT2AALDH1A1MEN1MAPTPOLB
Water SCHEMBL10716192 0.80 CRHBP (0.43) KMT2AALDH1A1MEN1MAPTPOLB
Hydrochloric Acid SCHEMBL6371205 0.80 CRHBP (0.43) KMT2AALDH1A1MEN1MAPTPOLB
SCHEMBL10603362 0.78 GPR35 (0.44) KMT2AALDH1A1MEN1MAPTPOLB
SCHEMBL1653003 0.78 GPR35 (0.44) KMT2AALDH1A1MEN1MAPTPOLB
SCHEMBL31711243 0.77 ALDH1A1 (0.46) KMT2AALDH1A1MEN1POLBL3MBTL1
SCHEMBL1695820 0.77 GPR35 (0.43) KMT2AALDH1A1MEN1MAPTPOLB
SCHEMBL8749879 0.77 HCAR3 (0.43) KMT2AALDH1A1MEN1MAPTPOLB

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
US-7229973-B2 pH-sensitive polymeric micelles for drug delivery UTAH, UNIVERSITY OF RESEARCH FOUNDATION 2007-06-12 US claimed
US-20050070721-A1 PH-sensitive polymeric micelles for drug delivery UNIVERSITY OF UTAH RESEARCH FOUNDATION 2005-03-31 US claimed
US-8263664-B2 pH-sensitive polymeric micelles for drug delivery UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2012-09-11 US disclosed
US-7951846-B2 pH-sensitive polymeric micelles for drug delivery BAE YOU HAN 2011-05-31 US disclosed
US-7659314-B2 PH-sensitive polymeric micelles for drug delivery UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2010-02-09 US disclosed
US-20100009926-A1 PH-SENSITIVE POLYMERIC MICELLES FOR DRUG DELIVERY UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2010-01-14 US disclosed
US-20090274753-A1 PH-SENSITIVE POLYMERIC MICELLES FOR DRUG DELIVERY UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2009-11-05 US disclosed
US-7229973-B2 pH-sensitive polymeric micelles for drug delivery UTAH, UNIVERSITY OF RESEARCH FOUNDATION 2007-06-12 US disclosed
US-20050186263-A1 PH-sensitive polymeric micelles for drug delivery UNIVERSITY OF UTAH RESEARCH FOUNDATION 2005-08-25 US disclosed
US-20050070721-A1 PH-sensitive polymeric micelles for drug delivery UNIVERSITY OF UTAH RESEARCH FOUNDATION 2005-03-31 US disclosed