SCHEMBL7145915

SCHEMBL7145915

COC(=O)[C@H](CCSC)NC(=O)c1ccc(NC(=S)c2cccnc2)cc1-c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.58
FNTB P49356 2/20 0.58
TDP1 Q9NUW8 2/20 0.58
KMT2A Q03164 1/20 0.49
PGGT1B P53609 1/20 0.48

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
SCHEMBL6775824 0.93 FNTA (0.61) FNTAFNTBTDP1KMT2APGGT1B
SCHEMBL7134723 0.93 FNTA (0.56) FNTAFNTBTDP1PGGT1B
SCHEMBL7134716 0.93 FNTA (0.56) FNTAFNTBTDP1PGGT1B
SCHEMBL6775820 0.93 FNTA (0.61) FNTAFNTBTDP1KMT2APGGT1B
SCHEMBL7609412 0.85 FNTA (0.59) FNTAFNTBTDP1PGGT1B
SCHEMBL7609414 0.85 FNTA (0.59) FNTAFNTBTDP1PGGT1B
Hydrochloric Acid SCHEMBL6781385 0.84 FNTA (0.58) FNTAFNTBTDP1PGGT1B
Hydrochloric Acid SCHEMBL6775831 0.84 FNTA (0.58) FNTAFNTBTDP1PGGT1B
Hydrochloric Acid SCHEMBL6775840 0.84 FNTA (0.58) FNTAFNTBTDP1PGGT1B
SCHEMBL6781966 0.84 FNTA (0.59) FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0873123-B1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 2003-04-09 EP disclosed
EP-0873123-A4 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 1999-02-03 EP disclosed
EP-0873123-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1998-10-28 EP disclosed
WO-1997017070-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1997-05-15 WO disclosed