SCHEMBL6659935

SCHEMBL6659935

CC(C)C[C@H](N)C(=O)OC(=O)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.45
ANPEP P15144 6/20 0.39
RNPEP Q9H4A4 2/20 0.39
DNPEP Q9ULA0 2/20 0.39
SLC1A3 P43003 2/20 0.36
SLC1A2 P43004 2/20 0.36
SCN9A Q15858 4/20 0.36
LAP3 P28838 4/20 0.31
ERAP1 Q9NZ08 1/20 0.31
MLYCD O95822 1/20 0.31
SLC1A1 P43005 1/20 0.31
LARS1 Q9P2J5 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL21978408 0.83
SCHEMBL9100153 0.82 SLC7A5 (0.58) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL995721 0.82 SLC7A5 (0.58) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL8629207 0.79 HTT (0.30)
SCHEMBL1681788 0.78 GRIN2D (0.32)
SCHEMBL4576494 0.78 DPP4 (0.33)
SCHEMBL9481259 0.77 PTGS1 (0.41)
SCHEMBL998946 0.76 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL1585736 0.76 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPSLC1A3
SCHEMBL7676359 0.76 SLC7A5 (0.52) SLC7A5ANPEPRNPEPDNPEPSLC1A3

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104507899-A Phenol derivative, preparation method and medical application thereof SICHUAN HAISCO PHARMACEUTICAL CO LTD 2015-04-08 CN disclosed
CN-101137665-A Desoxo-nonadepsipeptides AICURIS GMBH & CO KG (DE) 2008-03-05 CN disclosed
EP-1087935-B1 ANTHRACENE DERIVATIVES AS ANTI-CANCER AGENTS BTG INT LTD (GB) 2004-08-18 EP disclosed
US-20030203975-A1 Anti-cancer agents BTG INTERNATIONAL LIMITED (GB) 2003-10-30 US disclosed
EP-1087935-A1 ANTHRACENE DERIVATIVES AS ANTI-CANCER AGENTS BTG INTERNATIONAL LIMITED (GB) 2001-04-04 EP disclosed
WO-1999065866-A1 ANTHRACENE DERIVATIVES AS ANTI-CANCER AGENTS BTG INTERNATIONAL LIMITED (GB) 1999-12-23 WO disclosed
US-5689039-A HERBICIDE RESISTANCE THE UNIVERSITY OF TENNESSEE RESEARCH CORPORATION (US) 1997-11-18 US disclosed
EP-0577775-A4 ANTI-THROMBOTIC PEPTIDES AND PSEUDOPEPTIDES. RHONE POULENC RORER INT (US) 1995-01-11 EP disclosed
EP-0577775-A1 ANTI-THROMBOTIC PEPTIDES AND PSEUDOPEPTIDES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1994-01-12 EP disclosed
WO-1992017196-A1 ANTI-THROMBOTIC PEPTIDES AND PSEUDOPEPTIDES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-10-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030203975-A1 Anti-cancer agents TOP2B, TOP2A, TOP1 SLC7A5 757/4885ANPEP 364/4885RNPEP 205/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.