SCHEMBL14007657

SCHEMBL14007657

CCCC[C@H](NC(=O)OCc1ccccc1)C(=O)Br

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 2/20 0.69
▸ CTSS P25774 2/20 0.69
▸ SIRT2 Q8IXJ6 11/20 0.57
▸ SIRT1 Q96EB6 9/20 0.57
▸ SIRT3 Q9NTG7 4/20 0.56
▸ CTSK P43235 4/20 0.55
▸ CTSB P07858 1/20 0.55
▸ MME P08473 1/20 0.53
▸ ECE1 P42892 1/20 0.53

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
SCHEMBL4126228 0.89 CTSL (0.72) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL150166 0.89 CTSL (0.72) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL11332452 0.89 CTSL (0.72) CTSLCTSSSIRT2SIRT1SIRT3
Hydrochloric Acid SCHEMBL4438043 0.88 CTSL (0.70) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL15665359 0.88 CTSL (0.70) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL15665360 0.88 CTSL (0.70) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL16199245 0.87 CTSL (0.66) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL15586461 0.87 CTSL (0.69) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL10885373 0.87 CTSL (0.69) CTSLCTSSSIRT2SIRT1SIRT3
SCHEMBL16580328 0.87 CTSL (0.69) CTSLCTSSSIRT2SIRT1SIRT3

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-7456184-B2 Melanocortin receptor-specific compounds PALATIN TECHNOLOGIES INC. (US) 2008-11-25 — — US disclosed
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