SCHEMBL14601403

SCHEMBL14601403

CNC(=O)C(CC(C)c1ccccc1)C(CC(C)c1ccccc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 4/20 0.46
MMP1 P03956 2/20 0.46
MMP2 P08253 2/20 0.46
MMP3 P08254 2/20 0.46
MMP9 P14780 2/20 0.46
MMP14 P50281 2/20 0.46
LMNA P02545 1/20 0.44
TAAR1 Q96RJ0 1/20 0.43
MME P08473 4/20 0.42
APAF1 O14727 1/20 0.41
LTA4H P09960 1/20 0.41
ANPEP P15144 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SLC6A3 Q01959 1/20 0.41

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
SCHEMBL13948382 0.89 MMP1 (0.51) TRPA1MMP1MMP2MMP3MMP9
SCHEMBL13948388 0.89 MMP1 (0.51) TRPA1MMP1MMP2MMP3MMP9
SCHEMBL13921533 0.89 MMP1 (0.51) TRPA1MMP1MMP2MMP3MMP9
SCHEMBL14601401 0.88 MMP1 (0.44) TRPA1MMP1MMP2MMP3MMP9
SCHEMBL23812476 0.81 TRPA1 (0.50) TRPA1MMP1MMP2MMP3MMP9
SCHEMBL1716524 0.81 TRPA1 (0.53) TRPA1LMNATAAR1MMEAPAF1
SCHEMBL20182067 0.81 MEN1 (0.51) TRPA1LMNAMEN1KMT2A
SCHEMBL13924945 0.80 TRPA1 (0.52) TRPA1LMNATAAR1APAF1
SCHEMBL13948840 0.80 TRPA1 (0.52) TRPA1LMNATAAR1APAF1
SCHEMBL12715042 0.80 TRPA1 (0.52) TRPA1LMNATAAR1APAF1

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-7157269-B2 On-spot hydrophilic enhanced slide and preparation thereof INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2007-01-02 US disclosed