SCHEMBL6599441

SCHEMBL6599441

CCOCCCn1cncc1Cn1cc(-c2cccc3ccccc23)c([N+](=O)[O-])c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 14/20 0.44
FNTB P49356 14/20 0.44
PGGT1B P53609 3/20 0.40
CYP3A4 P08684 1/20 0.40
GSK3B P49841 1/20 0.38
QPCT Q16769 1/20 0.38
POLB P06746 1/20 0.35
NPC1 O15118 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 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
SCHEMBL27465419 0.87 CNR1 (0.46) FNTAFNTBPGGT1BCYP3A4GSK3B
SCHEMBL6599682 0.83 FNTA (0.44) FNTAFNTBPGGT1BCYP3A4POLB
SCHEMBL6599647 0.83 FNTA (0.50) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6599149 0.82 FNTA (0.57) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6608400 0.82 FNTA (0.44) FNTAFNTBPGGT1BCYP3A4GSK3B
SCHEMBL6610933 0.82 FNTA (0.48) FNTAFNTBPGGT1BCYP3A4POLB
SCHEMBL6598793 0.81 FNTA (0.47) FNTAFNTBPGGT1BCYP3A4POLB
SCHEMBL6602758 0.80 FNTA (0.46) FNTAFNTBPGGT1BCYP3A4GSK3B
SCHEMBL6605790 0.80 FNTA (0.46) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6599584 0.80 FNTA (0.44) 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
US-6511978-B1 For treating cancer, restenosis, atherosclerosis or viral infections LG LIFE SCIENCES, LTD. (KR) 2003-01-28 US claimed
JP-2002543074-A 2002-12-17 JP claimed
EP-1169320-A4 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD (KR) 2002-10-30 EP claimed
EP-1169320-A1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG Chem Investment, Ltd. (KR) 2002-01-09 EP claimed
WO-2000064891-A1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD. (KR) 2000-11-02 WO 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
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
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