SCHEMBL10715988

SCHEMBL10715988

CC(C)C(CP(=O)(O)C(CC1CCCCC1)NC(=O)OC(C)(C)C)N(C=O)Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 13/20 0.41
▸ MMP1 P03956 4/20 0.41
▸ MMP13 P45452 2/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ CACNA1B Q00975 1/20 0.39
▸ CTSS P25774 1/20 0.38
▸ CTSK P43235 1/20 0.38

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
SCHEMBL10716030 0.82 ECE1 (0.42) CTSSCTSK
SCHEMBL10716157 0.76 CTSK (0.47) RENMMP1MMP13KMT2ACACNA1B
SCHEMBL10715992 0.74 MDM2 (0.38) RENMEN1KMT2AATMCACNA1B
SCHEMBL10718398 0.73 BACE1 (0.47) RENCTSSCTSK
SCHEMBL1864929 0.72 REN (0.53) RENCACNA1BCTSSCTSK
SCHEMBL10715965 0.72 ACE2 (0.53) CTSSCTSK
SCHEMBL10717459 0.70 CTSS (0.45) RENKMT2ACTSSCTSK
SCHEMBL10717504 0.70 CTSS (0.45) RENKMT2ACTSSCTSK
SCHEMBL10717456 0.70 CTSS (0.45) RENKMT2ACTSSCTSK
SCHEMBL10717422 0.70 MMP1 (0.40) MMP1MMP13ATM

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
EP-0210545-A2 Phosphorous containing enzyme inhibitors MERCK & CO. INC. (US) 1987-02-04 — — EP claimed
EP-0210545-A2 Phosphorous containing enzyme inhibitors MERCK & CO. INC. (US) 1987-02-04 — — EP disclosed
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