SCHEMBL6602758

SCHEMBL6602758

COc1cccc(CCn2cncc2Cn2cc(-c3cccc4ccccc34)c([N+](=O)[O-])c2)c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 10/20 0.46
FNTB P49356 10/20 0.46
PGGT1B P53609 4/20 0.41
CYP3A4 P08684 1/20 0.41
GSK3B P49841 1/20 0.35
QPCT Q16769 1/20 0.35
IDO1 P14902 1/20 0.35

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
SCHEMBL6598793 0.92 FNTA (0.47) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6599647 0.89 FNTA (0.50) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6609116 0.88 FNTA (0.46) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6608400 0.86 FNTA (0.44) FNTAFNTBPGGT1BCYP3A4GSK3B
SCHEMBL6599584 0.84 FNTA (0.44) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6605790 0.84 FNTA (0.46) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6599682 0.84 FNTA (0.44) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6607574 0.81 FNTA (0.49) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6599441 0.80 FNTA (0.44) FNTAFNTBPGGT1BCYP3A4GSK3B
SCHEMBL6599149 0.80 FNTA (0.57) FNTAFNTBPGGT1BCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1169320-B1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD (KR) 2004-09-22 EP claimed
CN-1151148-C farnesyl transferase inhibitor with pyrrole structure and preparation method thereof LGCI��ʽ���� 2004-05-26 CN claimed
US-6511978-B1 For treating cancer, restenosis, atherosclerosis or viral infections LG LIFE SCIENCES, LTD. (KR) 2003-01-28 US claimed
CN-1346353-A farnesyl transferase inhibitor with pyrrole structure and preparation method thereof LG CHEMICAL LTD (KR) 2002-04-24 CN claimed
EP-1169320-B1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD (KR) 2004-09-22 EP disclosed
CN-1151148-C farnesyl transferase inhibitor with pyrrole structure and preparation method thereof LGCI��ʽ���� 2004-05-26 CN disclosed
US-6511978-B1 For treating cancer, restenosis, atherosclerosis or viral infections LG LIFE SCIENCES, LTD. (KR) 2003-01-28 US disclosed
EP-1169320-A4 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD (KR) 2002-10-30 EP disclosed
CN-1346353-A farnesyl transferase inhibitor with pyrrole structure and preparation method thereof LG CHEMICAL LTD (KR) 2002-04-24 CN disclosed
EP-1169320-A1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG Chem Investment, Ltd. (KR) 2002-01-09 EP disclosed
WO-2000064891-A1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD. (KR) 2000-11-02 WO disclosed