SCHEMBL9638879

SCHEMBL9638879

CS(=O)(=O)OCCOC(=O)C1CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
MMP9 P14780 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
TP53 P04637 1/20 0.37
MAPT P10636 2/20 0.34
POLB P06746 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PPP1CC P36873 1/20 0.33

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
SCHEMBL28404659 0.82 TP53 (0.38) ALDH1A1KDM4EUSP2LMNAMMP9
SCHEMBL207843 0.81 MAPT (0.39) ALDH1A1LMNAMAPTPPM1BPTPN1
SCHEMBL3108344 0.79 MEN1 (0.41) ALDH1A1LMNATP53MAPTPOLB
SCHEMBL16104755 0.76 MAPT (0.41) ALDH1A1KDM4EUSP2LMNAMMP9
SCHEMBL5003310 0.76 GAA (0.39) ALDH1A1LMNATSHRMAPTPOLB
SCHEMBL5003314 0.76 GAA (0.39) ALDH1A1LMNATSHRMAPTPOLB
SCHEMBL9961300 0.75 ALDH1A1 (0.40) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL6402662 0.75 MAPT (0.38) ALDH1A1MAPTPOLBPPM1BPTPN1
SCHEMBL4441643 0.74 SMN1; SMN2 (0.45) ALDH1A1MAPTKMT2ASMN1; SMN2
SCHEMBL879299 0.74 ALDH1A1 (0.39) ALDH1A1LMNATSHRTP53MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0269514-B1 DERIVATIVES OF 2,2-DIMETHYLCYCLOPROPANECARBOXYLIC ACID BEARING A SATURATED HALOGENATED CHAIN AT C-3, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION, THEIR USE AS PESTICIDES AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1992-08-26 EP disclosed