SCHEMBL14299552

SCHEMBL14299552

CCCC(NC(=O)OCc1ccccc1)C1NC(=O)OC1=O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.46
ATM Q13315 1/20 0.45
CTSL P07711 5/20 0.44
CTSS P25774 4/20 0.44
IDO1 P14902 2/20 0.43
TDO2 P48775 1/20 0.43
CTSB P07858 1/20 0.42
CTRB1 P17538 2/20 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
SCHEMBL7082474 0.86 CTSK (0.51) CTSKATMCTSLCTSSIDO1
SCHEMBL7013304 0.77 ALDH1A1 (0.43) ATMIDO1
SCHEMBL7323988 0.75 IDO1 (0.46) IDO1
SCHEMBL19933193 0.74 CTRB1 (0.62) CTSKATMCTSLCTSSCTSB
SCHEMBL19569920 0.73 POLB (0.61) CTSKATMCTSLCTSSCTSB
SCHEMBL9191194 0.72 LMNA (0.48) ATMIDO1TDO2
SCHEMBL7323991 0.72 LMNA (0.48) ATMIDO1TDO2
SCHEMBL7324582 0.72 LMNA (0.48) ATMIDO1TDO2
SCHEMBL27351869 0.72 SYK (0.63) CTSKATMCTSLCTSSCTSB
SCHEMBL20381057 0.72 CTSK (0.66) CTSKCTSLCTSSCTSBCTRB1

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-7330276-B2 Optical interference substrate, target detecting substrate, target detecting apparatus, and target detecting process FUJIFILM CORPORATION (JP) 2008-02-12 US disclosed