SCHEMBL5494778

SCHEMBL5494778

Cc1cccc(N(O)O)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.48
ATM Q13315 1/20 0.48
ALDH1A1 P00352 5/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPK1 P28482 1/20 0.39
MAPT P10636 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
ACHE P22303 1/20 0.36
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL585558 0.79 TRPA1 (0.46) TRPA1ATMALDH1A1MEN1KMT2A
SCHEMBL13547707 0.79 ACHE (0.47) ALDH1A1LMNATSHRACHECA1
SCHEMBL30733276 0.77 MAPT (0.48) TRPA1ATMALDH1A1MEN1KMT2A
SCHEMBL5436537 0.77 TRPA1 (0.44) TRPA1ATMALDH1A1MEN1KMT2A
SCHEMBL1911943 0.77 MAPT (0.48) TRPA1ATMALDH1A1MEN1KMT2A
SCHEMBL18837351 0.76 ALDH1A1 (0.37) TRPA1ATMALDH1A1LMNAMAPK1
SCHEMBL3278933 0.76 ALDH1A1 (0.50) TRPA1ATMALDH1A1MEN1KMT2A
SCHEMBL16860015 0.75 MAPT (0.46) TRPA1ATMALDH1A1MEN1KMT2A
SCHEMBL11192672 0.75 TRPA1 (0.42) TRPA1ATMALDH1A1MEN1KMT2A
SCHEMBL9751387 0.75 TRPA1 (0.42) TRPA1ATMALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070112166-A1 Pressure sensitive material LEATECH, LLC. (US) 2007-05-17 US disclosed
US-7176272-B2 Pressure sensitive material LEATECH, LLC (US) 2007-02-13 US disclosed
EP-1565505-A2 PRESSURE SENSITIVE MATERIAL Leatech, LLC (US) 2005-08-24 EP disclosed
WO-2004044865-A2 PRESSURE SENSITIVE MATERIAL LEATECH, LLC (US) 2004-05-27 WO disclosed
US-20040091695-A1 Pressure sensitive material LEATECH, LLC 2004-05-13 US disclosed