SCHEMBL28061324

SCHEMBL28061324

COC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)OC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.53
CTSB P07858 1/20 0.53
CTSS P25774 1/20 0.53
CTSK P43235 1/20 0.53
CAPN1 P07384 1/20 0.47
BIRC2 Q13490 3/20 0.47
PSEN1 P49768 4/20 0.45
PSEN2 P49810 4/20 0.45
APH1B Q8WW43 4/20 0.45
NCSTN Q92542 4/20 0.45
APH1A Q96BI3 4/20 0.45
PSENEN Q9NZ42 4/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
REN P00797 2/20 0.44
KMT2A Q03164 1/20 0.43
AAK1 Q2M2I8 1/20 0.43

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
SCHEMBL28061322 1.00 CTSL (0.53) CTSLCTSBCTSSCTSKCAPN1
SCHEMBL12555973 1.00 CTSL (0.53) CTSLCTSBCTSSCTSKCAPN1
SCHEMBL12588811 1.00 CTSL (0.53) CTSLCTSBCTSSCTSKCAPN1
SCHEMBL30064542 0.93 CTSL (0.55) CTSLCTSBCTSSCTSKCAPN1
SCHEMBL24130734 0.91 CTSL (0.52) CTSLCTSBCTSSCTSKCAPN1
SCHEMBL1176795 0.90 CTSL (0.62) CTSLCTSBCTSSCTSKCAPN1
SCHEMBL1026997 0.90 CTSL (0.62) CTSLCTSBCTSSCTSKCAPN1
SCHEMBL1026994 0.90 CTSL (0.62) CTSLCTSBCTSSCTSKCAPN1
SCHEMBL56907 0.89 CTSL (0.60) CTSLCTSBCTSSCTSKCAPN1
SCHEMBL55832 0.89 CTSL (0.60) CTSLCTSBCTSSCTSKCAPN1

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
CN-105622716-A Cyclic dipeptide used for wound healing GOOD DOCTOR PHARMACEUTICAL GROUP CO LTD 2016-06-01 CN disclosed