SCHEMBL9684529

SCHEMBL9684529

CS(=O)(=O)c1cc([Sn](C)(C)C)cc2c1C(=O)c1ccccc1-2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
MEN1 O00255 7/20 0.36
MAPT P10636 7/20 0.36
KMT2A Q03164 7/20 0.36
MAOA P21397 4/20 0.36
KDM4E B2RXH2 4/20 0.36
RAB9A P51151 4/20 0.36
MAPK1 P28482 3/20 0.36
NPC1 O15118 2/20 0.36
LMNA P02545 2/20 0.36
PLA2G1B P04054 2/20 0.36
RECQL P46063 2/20 0.36
ATG4B Q9Y4P1 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
CES2 O00748 1/20 0.36
APAF1 O14727 1/20 0.36
TERT O14746 1/20 0.36
PLIN1 O60240 1/20 0.36
TDP2 O95551 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
SCHEMBL9423239 0.75 MAPT (0.38) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL9685886 0.75 CDC25B (0.42) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL9684787 0.75 SOAT1 (0.39) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL9684783 0.75 MAPT (0.37) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL9683960 0.73 GRK6 (0.49) ALDH1A1MEN1MAPTKMT2AKDM4E
SCHEMBL9849269 0.71 ELANE (0.53) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL9685946 0.71 KEAP1 (0.51) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL9685976 0.71 MAPT (0.45) ALDH1A1SMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL9684465 0.71 MAPT (0.51) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL9685859 0.69 MAPT (0.36) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A

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