SCHEMBL7407249

SCHEMBL7407249

CC(C)[C@H](NC(=O)OCc1ccccc1)c1ncc[nH]1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 5/20 0.50
ATM Q13315 1/20 0.50
CTSK P43235 4/20 0.48
ELANE P08246 1/20 0.47
AAK1 Q2M2I8 2/20 0.47
CTSS P25774 2/20 0.46
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46

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
SCHEMBL9276917 1.00 FPR2 (0.50) FPR2ATMCTSKELANEAAK1
SCHEMBL7414757 0.88 ATM (0.58) FPR2ATMCTSKELANEAAK1
SCHEMBL7413361 0.86 ATM (0.43) ATMCTSKELANEAAK1
SCHEMBL7466082 0.85 AAK1 (0.61) ATMCTSKAAK1CTSSCTSL
SCHEMBL14923445 0.85 AAK1 (0.61) ATMCTSKAAK1CTSSCTSL
SCHEMBL7466643 0.85 AAK1 (0.61) ATMCTSKAAK1CTSSCTSL
SCHEMBL8880230 0.85 ATM (0.46) ATMCTSKELANEAAK1CTSS
SCHEMBL7421358 0.83 FPR2 (0.51) FPR2ATMCTSKAAK1CTSS
SCHEMBL3346730 0.82 TACR1 (0.53) ATMCTSKAAK1CTSSCTSL
SCHEMBL7417030 0.82 TACR1 (0.53) ATMCTSKAAK1CTSSCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190169181-A1 FUMAGILLOL COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN, INC. 2019-06-06 US disclosed
US-5733882-A Retroviral protease inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1998-03-31 US disclosed
EP-0602069-A4 RETROVIRAL PROTEASE INHIBITORS. SMITHKLINE BEECHAM CORP (US) 1995-05-03 EP disclosed
EP-0602069-A1 RETROVIRAL PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1994-06-22 EP disclosed
WO-1993002057-A1 RETROVIRAL PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1993-02-04 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-20190169181-A1 FUMAGILLOL COMPOUNDS AND METHODS OF MAKING AND USING SAME METAP2, DNPEP, FOLH1 FPR2 499/4885ATM 1810/4885CTSK 610/4885

“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.