SCHEMBL9683960

SCHEMBL9683960

C[Sn](C)(C)c1cc(C(N)=O)c2c(c1)-c1ccccc1C2=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRK6 P43250 1/20 0.49
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
MAPT P10636 5/20 0.44
ALDH1A1 P00352 5/20 0.44
LMNA P02545 2/20 0.44
TTR P02766 1/20 0.42
NPC1 O15118 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
THRB P10828 2/20 0.39
MAPK1 P28482 2/20 0.39
KDM4E B2RXH2 2/20 0.39
USP2 O75604 2/20 0.39
PKM P14618 1/20 0.39
MCL1 Q07820 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
FGFR1 P11362 1/20 0.38
FGFR2 P21802 1/20 0.38

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
SCHEMBL9685976 0.83 MAPT (0.45) MAPTALDH1A1LMNATTRNPC1
SCHEMBL9685946 0.83 KEAP1 (0.51) KEAP1MAPTALDH1A1LMNATTR
SCHEMBL9684465 0.83 MAPT (0.51) MAPTALDH1A1LMNATTRNPC1
SCHEMBL9684725 0.77 GRK6 (0.53) GRK6KEAP1NFE2L2MAPTALDH1A1
SCHEMBL9423239 0.76 MAPT (0.38) MAPTALDH1A1LMNATTRNPC1
SCHEMBL7829487 0.74 KEAP1 (0.73) GRK6KEAP1NFE2L2MAPTALDH1A1
SCHEMBL9316584 0.73 KEAP1 (0.57) GRK6KEAP1NFE2L2MAPTALDH1A1
SCHEMBL9684783 0.73 MAPT (0.37) MAPTALDH1A1LMNATTRNPC1
SCHEMBL9684529 0.73 ALDH1A1 (0.40) MAPTALDH1A1LMNATTRNPC1
SCHEMBL9685886 0.73 CDC25B (0.42) MAPTALDH1A1LMNATTRNPC1

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
US-5144028-A Antibiotics MERCK & CO., INC. (US) 1992-09-01 US disclosed
EP-0469844-A1 2-(9-fluorenonyl)-carbapenem MERCK & CO. INC. (US) 1992-02-05 EP disclosed
US-5025007-A 2-(9-fluorenonyl)-carbapenem antibacterial agents MERCK & CO., INC. (US) 1991-06-18 US disclosed