SCHEMBL8021180

SCHEMBL8021180

CC(C)(C)OC(=O)NC(C=CCO)CC1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 8/20 0.51
▸ CTSS P25774 2/20 0.51
▸ REN P00797 2/20 0.41
▸ CTSL P07711 2/20 0.40
▸ CTSB P07858 2/20 0.40
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ AAK1 Q2M2I8 1/20 0.39
▸ EPHX1 P07099 1/20 0.39
▸ CYP3A4 P08684 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ CACNA1B Q00975 1/20 0.36
▸ CTSH P09668 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
SCHEMBL7331001 1.00 CTSK (0.51) CTSKCTSSRENCTSLCTSB
SCHEMBL7384237 1.00 CTSK (0.51) CTSKCTSSRENCTSLCTSB
SCHEMBL7264536 0.88 CTSK (0.49) CTSKCTSSRENCTSLCTSB
SCHEMBL7264538 0.88 CTSK (0.49) CTSKCTSSRENCTSLCTSB
SCHEMBL9556578 0.88 CTSK (0.49) CTSKCTSSRENCTSLCTSB
SCHEMBL10656988 0.88 CTSK (0.52) CTSKCTSSRENCTSLCTSB
SCHEMBL7264559 0.87 CTSK (0.53) CTSKCTSSRENCTSLCTSB
SCHEMBL7264560 0.87 CTSK (0.53) CTSKCTSSRENCTSLCTSB
SCHEMBL9104071 0.86 CTSK (0.55) CTSKCTSSRENCTSLCTSB
SCHEMBL9104062 0.86 CTSK (0.55) CTSKCTSSRENCTSLCTSB

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
CN-1315321-A Process for preparing oxazoline compound DONG KOOK PHARM CO LTD (KR) 2001-10-03 — — CN disclosed
US-6127546-A Process for the preparation of oxazoline compound DONG KOOK PHARMACEUTICAL CO., LTD. (KR) 2000-10-03 — — US disclosed
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