SCHEMBL11511432

SCHEMBL11511432

OC(c1ccccc1)N(O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.39
MAPK1 P28482 1/20 0.39
SLC6A2 P23975 3/20 0.39
SLC6A4 P31645 3/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2C P18825 1/20 0.37
HIF1A Q16665 1/20 0.37

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
SCHEMBL6522565 0.77 LMNA (0.44) LMNAMAPK1KDM4EALDH1A1TSHR
SCHEMBL4786970 0.74 LMNA (0.41) LMNAMAPK1SLC6A2SLC6A4KDM4E
SCHEMBL9353616 0.74 ALOX5 (0.52) LMNAKDM4EALDH1A1ADRA2AADRA2C
SCHEMBL31480056 0.74 LMNA (0.46) LMNAMAPK1KDM4EALDH1A1TSHR
SCHEMBL9354511 0.73 ALOX5 (0.41) LMNASLC6A2SLC6A4KDM4EALDH1A1
Hydrochloric Acid SCHEMBL28637822 0.72 NPSR1 (0.40) LMNAKDM4EALDH1A1TSHRSMN1; SMN2
SCHEMBL1674631 0.70 KDM4E (0.58) LMNASLC6A2SLC6A4KDM4EALDH1A1
SCHEMBL6399613 0.70 ALDH1A1 (0.44) LMNAKDM4EALDH1A1TSHRSMN1; SMN2
SCHEMBL11141579 0.70 LMNA (0.47) LMNASLC6A2SLC6A4ALDH1A1TSHR
SCHEMBL449664 0.70 NPSR1 (0.44) LMNAMAPK1ALDH1A1TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4152452-A N-BENZYLANILINE AND DERIVATIVES WILLIAM H. RORER, INC. (US) 1979-05-01 US disclosed