SCHEMBL8569165

SCHEMBL8569165

O=[N+]([O-])c1ccncc1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 4/20 0.54
CYP11B2 P19099 4/20 0.54
CYP19A1 P11511 2/20 0.54
PIN1 Q13526 2/20 0.52
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
ATM Q13315 1/20 0.50
MAPT P10636 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
POLB P06746 2/20 0.45
RECQL P46063 1/20 0.45
CTSV O60911 1/20 0.44
CTSL P07711 1/20 0.44
ALDH1A1 P00352 1/20 0.44
ABCB1 P08183 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44

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
SCHEMBL1936411 0.88 CYP11B1 (0.54) CYP11B1CYP11B2CYP19A1PIN1MEN1
SCHEMBL2771800 0.86 MAPT (0.48) CYP11B1CYP11B2CYP19A1MEN1KMT2A
SCHEMBL2772158 0.86 MEN1 (0.48) CYP11B1CYP11B2CYP19A1PIN1MEN1
SCHEMBL14988733 0.82 RAB9A (0.60) CYP11B1CYP11B2CYP19A1MEN1KMT2A
SCHEMBL14988688 0.81 RAB9A (0.57) CYP11B1CYP11B2CYP19A1MEN1KMT2A
SCHEMBL2305236 0.81 NPC1 (0.68) PIN1MEN1KMT2ARAB9ANPC1
SCHEMBL30015078 0.81 NPC1 (0.68) PIN1MEN1KMT2ARAB9ANPC1
SCHEMBL28087330 0.78 ALDH1A1 (0.50) CYP11B1CYP11B2MEN1KMT2ARAB9A
SCHEMBL3585058 0.78 MGMT (0.52) CYP11B1CYP11B2CYP19A1PIN1MEN1
SCHEMBL8316270 0.78 MEN1 (0.55) CYP11B1CYP11B2CYP19A1PIN1MEN1

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
EP-0735025-B1 Process for producing aminonitropyridines SUMITOMO CHEMICAL CO (JP) 1998-07-01 EP disclosed
US-5648496-A AMINATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-15 US disclosed
EP-0735025-A1 Process for producing aminonitropyridines SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-10-02 EP disclosed