SCHEMBL6601724

SCHEMBL6601724

CN1CCN(C(=O)c2cn(Cc3cncn3CCc3cccs3)cc2-c2cccc3ccccc23)CC1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 15/20 0.68
FNTB P49356 15/20 0.68
PGGT1B P53609 3/20 0.68
CYP3A4 P08684 1/20 0.68
HTR2C P28335 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL6972928 0.90 FNTA (0.71) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6603201 0.90 FNTA (0.71) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6977970 0.87 FNTA (0.70) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6982144 0.87 FNTA (0.70) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6985249 0.87 FNTA (0.73) FNTAFNTBPGGT1BCYP3A4KDM4E
SCHEMBL6983570 0.87 FNTA (0.69) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6982585 0.87 FNTA (0.67) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6975476 0.87 FNTA (0.71) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6982723 0.87 FNTA (0.67) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6972967 0.86 FNTA (0.75) FNTAFNTBPGGT1BCYP3A4HTR2C

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 1 patent. 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