SCHEMBL14836709

SCHEMBL14836709

NC(=O)N(c1ccc2ccccc2n1)c1ccc2ccccc2n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 2/20 0.53
MGAM O43451 1/20 0.47
MAPT P10636 2/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
NOS2 P35228 1/20 0.44
BACE1 P56817 1/20 0.44
CNR2 P34972 3/20 0.43
HDAC8 Q9BY41 1/20 0.43
IKBKB O14920 1/20 0.42
KDM4E B2RXH2 4/20 0.41
LMNA P02545 2/20 0.41
CYP1A2 P05177 3/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HIF1A Q16665 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL28341084 0.84 NCF1 (0.52) NCF1MGAMMAPTALDH1A1GAA
SCHEMBL6793352 0.83 NCF1 (0.41) NCF1MGAMMAPTALDH1A1GAA
SCHEMBL2781511 0.82 NCF1 (0.50) NCF1MGAMMAPTALDH1A1GAA
SCHEMBL6709580 0.76 ALOX5 (0.40) NCF1ALDH1A1GAAKDM4ELMNA
SCHEMBL12014904 0.73 NCF1 (0.68) NCF1MGAMMAPTALDH1A1NOS2
SCHEMBL4783071 0.73 NCF1 (0.61) NCF1MGAMMAPTALDH1A1CNR2
Anthracene SCHEMBL10594874 0.73 NCF1 (0.47) NCF1MGAMMAPTALDH1A1GAA
SCHEMBL6897117 0.72 NCF1 (0.46) NCF1MGAMMAPTALDH1A1GAA
SCHEMBL6276706 0.71 NCF1 (0.59) NCF1MGAMMAPTALDH1A1GAA
Hydrochloric Acid SCHEMBL11799344 0.71 NCF1 (0.59) NCF1MGAMMAPTALDH1A1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130189368-A1 NANOPARTICULATE COMPOSITION CONTAINING ANTIBIOTICS FOR INTRAMAMMARY ADMINISTRATION IN ANIMALS UNIVERSIDADE FEDERAL DE OURO PRETO (BR) 2013-07-25 US claimed
CN-103118670-A Nanoparticle compositions containing antibiotics for intramammary administration in animals UNIV FED OURO PRETO 2013-05-22 CN claimed
EP-2578209-A1 NANOPARTICULATE COMPOSITION CONTAINING ANTIBIOTICS FOR INTRAMAMMARY ADMINISTRATION IN ANIMALS Universidade Federal De Ouro Preto (BR) 2013-04-10 EP claimed
CN-103305562-A Production process of paranitroaniline NANJING UNIVERSITY OF TECHNOLOGY 2013-09-18 CN disclosed
CN-103118670-A Nanoparticle compositions containing antibiotics for intramammary administration in animals UNIV FED OURO PRETO 2013-05-22 CN disclosed
CN-102065846-A Solid dosage form for treating headaches PAINDURE LTD 2011-05-18 CN disclosed
CN-101686682-A therapeutic pyrazoloquinoline urea derivatives HELICON THERAPEUTICS INC 2010-03-31 CN disclosed