SCHEMBL204255

SCHEMBL204255

O=C(N[C@@H](Cn1ccnc1)C(=O)OC1CCCCO1)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 5/20 0.44
CTSK P43235 4/20 0.44
CTSS P25774 3/20 0.44
HRH4 Q9H3N8 1/20 0.44
CYP19A1 P11511 1/20 0.43
CYP1A2 P05177 1/20 0.42
CASP1 P29466 4/20 0.42
PADI4 Q9UM07 1/20 0.41
CD274 Q9NZQ7 1/20 0.40
CTSB P07858 2/20 0.40

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
SCHEMBL204254 1.00 CYP26A1 (0.44) CYP26A1CTSKCTSSHRH4CYP19A1
SCHEMBL7284532 0.80 HRH4 (0.55) CYP26A1CTSKCTSSHRH4CYP19A1
SCHEMBL201199 0.77 CYP2B6 (0.36) CYP26A1
SCHEMBL201200 0.77 CYP2B6 (0.36) CYP26A1
SCHEMBL7298338 0.71 CYP1A2 (0.53) CTSKCTSSCYP1A2CASP1CTSB
SCHEMBL22236504 0.71 CYP26A1 (0.57) CYP26A1HRH4CYP1A2PADI4
SCHEMBL16359763 0.70 CYP1A2 (0.47) CYP1A2
SCHEMBL26130427 0.70 CYP1A2 (0.60) CTSKCTSSCYP1A2CASP1CTSB
SCHEMBL26130430 0.70 CYP1A2 (0.60) CTSKCTSSCYP1A2CASP1CTSB
SCHEMBL5885746 0.69 CTSK (0.47) CTSKCTSSCYP1A2CASP1CTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088804-B2 N-hydroxyamide derivatives possessing antibacterial activity PFIZER INC. (US) 2012-01-03 US disclosed
EP-2338878-A2 N-hydroxyamide derivatives possessing antibacterial activity Vicuron Pharmaceuticals, Inc. (US) 2011-06-29 EP disclosed