SCHEMBL6601972

SCHEMBL6601972

COC(=O)c1c(-c2cccc3ccccc23)cn(Cc2cncn2Cc2ccc3c(c2)OCO3)c1C

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FNTA P49354 7/20 0.62
FNTB P49356 7/20 0.62
PGGT1B P53609 5/20 0.62
CYP3A4 P08684 1/20 0.61
MAPT P10636 2/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MAPK10 P53779 1/20 0.43
HIF1A Q16665 1/20 0.43
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.39
RECQL P46063 1/20 0.39

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
SCHEMBL6600385 0.91 FNTA (0.63) FNTAFNTBPGGT1BCYP3A4MAPT
SCHEMBL6598192 0.86 FNTA (0.77) FNTAFNTBPGGT1BCYP3A4LMNA
SCHEMBL6599904 0.85 FNTA (0.56) FNTAFNTBPGGT1BCYP3A4MAPT
SCHEMBL6599882 0.82 FNTA (0.59) FNTAFNTBPGGT1BCYP3A4MAPT
SCHEMBL6598941 0.81 FNTA (0.73) FNTAFNTBPGGT1BCYP3A4LMNA
SCHEMBL6596849 0.79 FNTA (0.71) FNTAFNTBPGGT1BCYP3A4MAPT
SCHEMBL2287583 0.76 FNTA (1.00) FNTAFNTBPGGT1BCYP3A4HSD17B10
SCHEMBL6601970 0.75 FNTA (0.41) FNTAFNTBPGGT1BCYP3A4MAPT
SCHEMBL6600154 0.75 FNTA (0.66) FNTAFNTBPGGT1BCYP3A4LMNA
SCHEMBL7087230 0.75 FNTA (1.00) FNTAFNTBPGGT1BCYP3A4KDM4E

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 2 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 disclosed
US-6511978-B1 For treating cancer, restenosis, atherosclerosis or viral infections LG LIFE SCIENCES, LTD. (KR) 2003-01-28 US disclosed