SCHEMBL6598939

SCHEMBL6598939

CSc1c(C(=O)N2CCN(C)CC2)c(-c2cccc3ccccc23)cn1C(Cc1ccc2c(c1)OCO2)c1cnc[nH]1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FNTA P49354 5/20 0.51
FNTB P49356 5/20 0.51
PGGT1B P53609 3/20 0.51
CYP3A4 P08684 1/20 0.51
GAA P10253 1/20 0.38
KMT2A Q03164 2/20 0.37
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
NR1H4 Q96RI1 1/20 0.36
POLB P06746 1/20 0.36
ACACB O00763 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
SCHEMBL6596847 0.93 FNTA (0.49) FNTAFNTBPGGT1BCYP3A4GAA
SCHEMBL6598190 0.92 FNTA (0.52) FNTAFNTBPGGT1BCYP3A4GAA
SCHEMBL4955195 0.85 FNTA (0.60) FNTAFNTBPGGT1BCYP3A4KMT2A
SCHEMBL6599881 0.83 FNTA (0.39) FNTAFNTBPGGT1BCYP3A4KMT2A
SCHEMBL6600381 0.82 FNTA (0.41) FNTAFNTBPGGT1BCYP3A4GAA
SCHEMBL6601970 0.81 FNTA (0.41) FNTAFNTBPGGT1BCYP3A4GAA
SCHEMBL6599899 0.81 FNTA (0.42) FNTAFNTBPGGT1BCYP3A4GAA
SCHEMBL6598941 0.78 FNTA (0.73) FNTAFNTBPGGT1BCYP3A4GAA
SCHEMBL6977268 0.77 FNTA (0.59) FNTAFNTBPGGT1BCYP3A4KMT2A
SCHEMBL6599696 0.74 FNTA (0.55) FNTAFNTBPGGT1BCYP3A4KMT2A

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 3 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
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