SCHEMBL9685943

SCHEMBL9685943

CS(=O)(=O)c1ccc2c(c1)C(=O)c1ccc([Sn](C)(C)C)cc1-2

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PKM P14618 4/20 0.41
PARG Q86W56 4/20 0.39
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
GAA P10253 1/20 0.36
ENPP2 Q13822 1/20 0.36
APEX1 P27695 1/20 0.36
PTGS2 P35354 4/20 0.35

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
SCHEMBL9685874 0.97 ENPP2 (0.38) PKMPARGMEN1KMT2ASMN1; SMN2
SCHEMBL17948135 0.82 PKM (0.53) PKMPARGALDH1A1MEN1KMT2A
SCHEMBL9849269 0.79 ELANE (0.53) ALDH1A1MEN1KMT2ASMN1; SMN2POLB
SCHEMBL29117498 0.77 ELANE (0.55) PARGALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL7125518 0.77 PARG (0.59) PKMPARGALDH1A1MEN1KMT2A
SCHEMBL11085074 0.77 ESR1 (0.62) PKMPARGALDH1A1MEN1KMT2A
SCHEMBL9685898 0.74 BCL2 (0.39) ALDH1A1SMN1; SMN2TSHRMAPTMAPK1
SCHEMBL9684483 0.74 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2TSHRMAPTMAPK1
SCHEMBL29117512 0.74 ENPP2 (0.54) ENPP2PTGS2
SCHEMBL10070529 0.74 PARG (0.44) PKMPARGALDH1A1MEN1KMT2A

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