SCHEMBL7489643

SCHEMBL7489643

COC(=O)CNC(C)C(Cc1ccc(C(=O)Nc2ccccc2)o1)c1ccc2c(c1)OCO2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
NPC1 O15118 6/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
MAPT P10636 4/20 0.44
PKM P14618 3/20 0.44
TP53 P04637 3/20 0.44
OGA O60502 1/20 0.42
RAB9A P51151 7/20 0.42
TSHR P16473 2/20 0.42
LMNA P02545 2/20 0.42
HSD17B10 Q99714 1/20 0.42
FFAR1 O14842 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HTT P42858 1/20 0.41
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40

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
SCHEMBL7496837 0.91 POLB (0.48) POLBNPC1SMN1; SMN2MAPTPKM
SCHEMBL7496557 0.87 POLB (0.44) POLBNPC1SMN1; SMN2MAPTPKM
SCHEMBL7496559 0.87 POLB (0.44) POLBNPC1SMN1; SMN2MAPTPKM
SCHEMBL7493231 0.87 RAB9A (0.48) POLBNPC1SMN1; SMN2MAPTPKM
SCHEMBL7493914 0.86 POLB (0.46) POLBNPC1SMN1; SMN2MAPTPKM
SCHEMBL7487064 0.86 POLB (0.46) POLBNPC1SMN1; SMN2MAPTPKM
SCHEMBL7487231 0.86 POLB (0.46) POLBNPC1SMN1; SMN2MAPTPKM
SCHEMBL7498461 0.86 POLB (0.46) POLBNPC1SMN1; SMN2MAPTPKM
SCHEMBL7484687 0.85 POLB (0.45) POLBNPC1SMN1; SMN2MAPTPKM
SCHEMBL7491235 0.85 POLB (0.45) POLBNPC1SMN1; SMN2MAPTPKM

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-0989114-B1 N,N-DISUBSTITUTED AMIC ACID DERIVATIVES BANYU PHARMA CO LTD (JP) 2002-07-24 EP disclosed
EP-0989114-A1 N,N-DISUBSTITUTED AMIC ACID DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-03-29 EP disclosed
US-5981573-A INHIBIT PROTEIN-FARNESYL TRANSFERASE (PFT) IN VIVO THEREBY SUPPRESSING FUNCTION OF ONCOGENE PROTEIN RAS AND THUS PRESENTING ANTITUMOR ACTIVITIES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-11-09 US disclosed