SCHEMBL5580160

SCHEMBL5580160

CC(C)[C@](Cc1ccc([N+](=O)[O-])cc1)(NC(=O)c1cccc2ccccc12)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 9/20 0.49
WDR5 P61964 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42

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
SCHEMBL5580156 1.00 CCR3 (0.49) CCR3WDR5MEN1KMT2AGAA
SCHEMBL5580414 0.85 CCR3 (0.48) CCR3WDR5MEN1KMT2AGAA
SCHEMBL5580412 0.85 CCR3 (0.48) CCR3WDR5MEN1KMT2AGAA
SCHEMBL5580149 0.84 CCR3 (0.49) CCR3WDR5MEN1KMT2AGAA
SCHEMBL5580151 0.84 CCR3 (0.49) CCR3WDR5MEN1KMT2AGAA
SCHEMBL5580161 0.83 CCR3 (0.49) CCR3WDR5MEN1KMT2AGAA
SCHEMBL5580159 0.83 CCR3 (0.49) CCR3WDR5MEN1KMT2AGAA
SCHEMBL7608481 0.74 CCR3 (0.66) CCR3MEN1KMT2A
SCHEMBL8014171 0.74 CCR3 (0.66) CCR3MEN1KMT2A
SCHEMBL7899407 0.73 SMN1; SMN2 (0.61) CCR3MEN1KMT2AMAPT

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-20070249915-A1 Inhibitors SHISEIDO COMPANY, LTD. (JP) 2007-10-25 US disclosed