SCHEMBL9019149

SCHEMBL9019149

N#Cc1ccn(O)c1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.47
MAOB P27338 2/20 0.47
ALDH1A1 P00352 7/20 0.39
LMNA P02545 4/20 0.39
KDM4E B2RXH2 4/20 0.38
HPGD P15428 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
TSHR P16473 1/20 0.38
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37
MAPK1 P28482 1/20 0.36
ESR2 Q92731 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MCL1 Q07820 1/20 0.35
HIF1A Q16665 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL9019067 0.81 KDM4E (0.41) MAOAMAOBALDH1A1LMNAKDM4E
SCHEMBL1780782 0.77 ALDH1A1 (0.47) MAOAMAOBALDH1A1LMNAKDM4E
SCHEMBL10446057 0.77 MAOA (0.43) MAOAMAOBALDH1A1LMNAKDM4E
Biphenyl SCHEMBL28489818 0.67 ALDH1A1 (0.53) MAOAMAOBALDH1A1LMNAKDM4E
Biphenyl SCHEMBL20271004 0.67 ALDH1A1 (0.53) MAOAMAOBALDH1A1LMNAKDM4E
Biphenyl SCHEMBL27604303 0.63 ALDH1A1 (0.64) ALDH1A1LMNAHPGDSMN1; SMN2TSHR
Biphenyl SCHEMBL20530383 0.63 ALDH1A1 (0.64) ALDH1A1LMNAHPGDSMN1; SMN2TSHR
Benzene SCHEMBL27565604 0.63 TSHR (0.60) MAOAMAOBALDH1A1LMNAKDM4E
SCHEMBL223 0.61 ESR2 (0.69) MAOAMAOBALDH1A1KDM4EHPGD
SCHEMBL29662886 0.61 ESR2 (0.69) MAOAMAOBALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0434940-B1 N-oxygenated arylpyrrole, insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID CO (US) 1996-05-29 EP disclosed
US-5399716-A N-oxygenated arylpyrrole insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID COMPANY (US) 1995-03-21 US disclosed
US-5347016-A N-oxygenated arylpyrrole intermediates for insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID COMPANY (US) 1994-09-13 US disclosed
US-5232979-A Insecticides, miticides, nematocides AMERICAN CYANAMID COMPANY (US) 1993-08-03 US disclosed
US-5102904-A N-OXYGENATED ARYLPYRROLE INSECTICIDAL, ACARICIDAL AND NEMATICIDAL AGENTS AND USE THEREAS AMERICAN CYANAMID COMPANY (US) 1992-04-07 US disclosed
EP-0434940-A2 N-oxygenated arylpyrrole, insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID COMPANY (US) 1991-07-03 EP disclosed