SCHEMBL6624185

SCHEMBL6624185

CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1-c1ccccc1)C(=O)OCC[Si](C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
MAPT P10636 1/20 0.49
FNTA P49354 4/20 0.49
FNTB P49356 4/20 0.49
TDP1 Q9NUW8 2/20 0.49
PGGT1B P53609 1/20 0.45
CRHBP P24387 1/20 0.43
MAPK1 P28482 1/20 0.43
CRHR2 Q13324 1/20 0.43

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
SCHEMBL6778337 1.00 ALDH1A1 (0.55) ALDH1A1MAPTFNTAFNTBTDP1
SCHEMBL6775900 0.88 FNTA (0.61) ALDH1A1MAPTFNTAFNTBTDP1
SCHEMBL6775897 0.88 FNTA (0.61) ALDH1A1MAPTFNTAFNTBTDP1
SCHEMBL8584881 0.85 FNTA (0.58) ALDH1A1MAPTFNTAFNTBTDP1
SCHEMBL6625988 0.85 FNTA (0.54) FNTAFNTBTDP1PGGT1B
SCHEMBL6625989 0.85 FNTA (0.54) FNTAFNTBTDP1PGGT1B
SCHEMBL8365768 0.85 FNTA (0.58) ALDH1A1MAPTFNTAFNTBTDP1
SCHEMBL8365497 0.83 FNTA (0.58) ALDH1A1MAPTFNTAFNTBTDP1
SCHEMBL8365758 0.79 ALDH1A1 (0.53) ALDH1A1MAPTFNTAFNTBTDP1
SCHEMBL6775666 0.78 FNTA (0.59) ALDH1A1MAPTFNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0986384-A4 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 2004-09-15 EP disclosed
US-6693123-B2 (4-(3-PYRIDYLAMINOMETHYLENE)-2-PHENYLBENZOYL)-N -METHYLMETHIONINE, METHYL ESTER FOR EXAMPLE; RESTENOSIS, HYPERPLASIA UNIVERSITY OF PITTSBURGH 2004-02-17 US disclosed
US-20020193596-A1 Inhibitors of protein isoprenyl transferases UNIVERSITY OF PITTSBURGH (US) 2002-12-19 US disclosed
US-6310095-B1 INHIBITING OR TREATING CANCER, TREATING INTIMAL HYPERPLASIA ASSOCIATED WITH RESTENOSIS AND ATHEROSCLEROSIS, INHIBITING POST-TRANSLATIONAL MODIFICATION OF ONCOGENIC RAS PROTEIN BY PROTEIN FARNESYLTRANSFERASE AND/OR GERANYLGERANYLTRANSFERASE UNIVERSITY OF PITTSBURGH 2001-10-30 US disclosed
EP-0986384-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 2000-03-22 EP disclosed
WO-1998050029-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1998-11-12 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-20020193596-A1 Inhibitors of protein isoprenyl transferases LANCL1, FNTB, DHCR7 ALDH1A1 1121/4885MAPT 4674/4885FNTA 20/4885

“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.