SCHEMBL6598323

SCHEMBL6598323

Cc1nc[nH]c1C(Cc1ccc2c(c1)OCO2)n1cc(C(=O)O)c(-c2cccc3ccccc23)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 3/20 0.41
FNTB P49356 3/20 0.41
PGGT1B P53609 3/20 0.41
CYP3A4 P08684 1/20 0.41
KDM4E B2RXH2 3/20 0.39
TP53 P04637 2/20 0.39
DHODH Q02127 1/20 0.39
PKM P14618 1/20 0.37
NR1H4 Q96RI1 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTT P42858 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36

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
SCHEMBL6599375 0.91 FNTA (0.45) FNTAFNTBPGGT1BCYP3A4KDM4E
SCHEMBL6599572 0.89 FNTA (0.49) FNTAFNTBPGGT1BCYP3A4KDM4E
SCHEMBL6601438 0.87 FNTA (0.47) FNTAFNTBPGGT1BCYP3A4KDM4E
SCHEMBL6599696 0.81 FNTA (0.55) FNTAFNTBPGGT1BCYP3A4KDM4E
SCHEMBL6607626 0.81 FNTA (0.55) FNTAFNTBPGGT1BCYP3A4KDM4E
SCHEMBL6598883 0.81 FNTA (0.47) FNTAFNTBPGGT1BCYP3A4KDM4E
SCHEMBL6599733 0.81 FNTA (0.48) FNTAFNTBPGGT1BCYP3A4KDM4E
SCHEMBL6600663 0.78 KDM4E (0.44) FNTAFNTBPGGT1BCYP3A4KDM4E
SCHEMBL6600318 0.75 FNTA (0.58) FNTAFNTBPGGT1BCYP3A4KDM4E
SCHEMBL4955195 0.75 FNTA (0.60) 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 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 disclosed