SCHEMBL9684783

SCHEMBL9684783

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.37
ALDH1A1 P00352 6/20 0.37
THRB P10828 3/20 0.37
LCK P06239 1/20 0.37
GLA P06280 1/20 0.37
LIMK1 P53667 1/20 0.37
LIMK2 P53671 1/20 0.37
MEN1 O00255 7/20 0.36
KMT2A Q03164 7/20 0.36
MAOA P21397 4/20 0.36
MAPK1 P28482 4/20 0.36
LMNA P02545 4/20 0.36
KDM4E B2RXH2 3/20 0.36
RAB9A P51151 3/20 0.36
RECQL P46063 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
BLM P54132 2/20 0.36
CES2 O00748 1/20 0.36
APAF1 O14727 1/20 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
SCHEMBL9685863 0.80 MAPT (0.36) MAPTALDH1A1THRBLCKGLA
SCHEMBL9685859 0.80 MAPT (0.36) MAPTALDH1A1THRBLCKGLA
SCHEMBL9685509 0.76 PTPRC (0.50) MAPTALDH1A1THRBLCKGLA
SCHEMBL9684529 0.75 ALDH1A1 (0.40) MAPTALDH1A1THRBMEN1KMT2A
SCHEMBL9685886 0.75 CDC25B (0.42) MAPTALDH1A1THRBMEN1KMT2A
SCHEMBL9423239 0.75 MAPT (0.38) MAPTALDH1A1THRBMEN1KMT2A
SCHEMBL9684787 0.75 SOAT1 (0.39) MAPTALDH1A1THRBMEN1KMT2A
SCHEMBL9683960 0.73 GRK6 (0.49) MAPTALDH1A1THRBGLAMEN1
SCHEMBL5158317 0.72 MAPT (0.48) MAPTALDH1A1THRBGLAMEN1
SCHEMBL7462537 0.71 PTPRC (0.55) MAPTALDH1A1MEN1KMT2AMAPK1

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