SCHEMBL9575060

SCHEMBL9575060

COP(=O)(OC)C(O)[C@H](CC1CCCCC1)N(C(=O)[C@@H](N)Cc1ccccc1)[C@@H](Cc1cncn1COCc1ccccc1)C(=O)NC(=O)C1CCCC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 5/20 0.33
▸ CTSD P07339 1/20 0.32
▸ CTSL P07711 2/20 0.31
▸ CTSB P07858 1/20 0.31
▸ REN P00797 5/20 0.31
▸ PLK1 P53350 1/20 0.31
▸ PLK3 Q9H4B4 1/20 0.31
▸ PLK2 Q9NYY3 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ PSMB11 A5LHX3 1/20 0.31
▸ PSMA7 O14818 1/20 0.31
▸ PSMB1 P20618 1/20 0.31
▸ PSMA1 P25786 1/20 0.31
▸ PSMA2 P25787 1/20 0.31
▸ PSMA3 P25788 1/20 0.31
▸ PSMA4 P25789 1/20 0.31
▸ PSMB8 P28062 1/20 0.31
▸ PSMB9 P28065 1/20 0.31
▸ PSMA5 P28066 1/20 0.31

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
SCHEMBL7431811 0.82 PSMB5 (0.41) CTSDRENPSMB5
SCHEMBL7427990 0.80 REN (0.38) CTSSCTSLCTSBREN
SCHEMBL7428042 0.80 REN (0.36) CTSDRENALDH1A1
SCHEMBL9575055 0.78 REN (0.45) CTSSCTSLRENPSMB5
SCHEMBL7366123 0.76 CTSS (0.33) CTSSCTSLCTSBPSMB11PSMA7
SCHEMBL7427996 0.76 PLK1 (0.36) CTSSCTSDCTSLCTSBREN
SCHEMBL7432319 0.75 PSMB5 (0.40) CTSDRENPSMB5
SCHEMBL9575107 0.74 REN (0.38) CTSSCTSDCTSLCTSBREN
SCHEMBL7493678 0.73 PSMB5 (0.42) CTSDRENPSMB5
SCHEMBL9575108 0.73 REN (0.45) CTSSCTSLCTSBRENPLK1

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-5217958-A Hypotensive agents E. R. SQUIBB & SONS, INC. (US) 1993-06-08 — — US disclosed
WO-1989007940-A1 1,2-HYDROXY PHOSPHONATES AND DERIVATIVES THEREOF E.R. SQUIBB & SONS, INC. (US) 1989-09-08 — — WO disclosed
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