SCHEMBL6776648

SCHEMBL6776648

CC(C)(C)OC(=O)NC(CCCCS)CCC(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.52
MAPT P10636 1/20 0.48
HDAC4 P56524 2/20 0.48
HDAC1 Q13547 2/20 0.48
ATM Q13315 1/20 0.47
CTRB1 P17538 2/20 0.46
PPARA Q07869 1/20 0.44
KLK7 P49862 2/20 0.44
KLK5 Q9Y337 2/20 0.44
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
CTSL P07711 1/20 0.42

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
SCHEMBL25907995 0.87 SYK (0.56) SYKMAPTATMCTRB1PPARA
SCHEMBL24298360 0.85 SYK (0.57) SYKMAPTATMCTRB1PPARA
SCHEMBL3466395 0.85 SYK (0.57) SYKMAPTATMCTRB1PPARA
SCHEMBL3466396 0.85 SYK (0.57) SYKMAPTATMCTRB1PPARA
SCHEMBL17513638 0.84 SYK (0.56) SYKMAPTATMCTRB1PPARA
SCHEMBL18575403 0.84 SYK (0.56) SYKMAPTATMCTRB1PPARA
SCHEMBL25318929 0.84 SYK (0.56) SYKMAPTATMCTRB1PPARA
SCHEMBL8607451 0.84 SYK (0.55) SYKMAPTATMCTRB1PPARA
SCHEMBL10270725 0.83 SYK (0.54) SYKMAPTATMCTRB1PPARA
SCHEMBL25907996 0.82 SYK (0.51) SYKMAPTATMPPARAKLK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6693123-B2 (4-(3-PYRIDYLAMINOMETHYLENE)-2-PHENYLBENZOYL)-N -METHYLMETHIONINE, METHYL ESTER FOR EXAMPLE; RESTENOSIS, HYPERPLASIA UNIVERSITY OF PITTSBURGH 2004-02-17 US disclosed
EP-0873123-B1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 2003-04-09 EP disclosed
US-20020193596-A1 Inhibitors of protein isoprenyl transferases UNIVERSITY OF PITTSBURGH (US) 2002-12-19 US 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-20020193596-A1 Inhibitors of protein isoprenyl transferases LANCL1, FNTB, DHCR7 SYK 4686/4885MAPT 4674/4885HDAC4 3501/4885

“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.