SCHEMBL9523585

SCHEMBL9523585

[CH2]C(CCC(=O)NC)C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 2/20 0.32
ZDHHC7 Q9NXF8 1/20 0.32
MAPT P10636 1/20 0.32
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
TSHR P16473 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
POLB P06746 1/20 0.31
MCL1 Q07820 1/20 0.30

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
SCHEMBL9191996 0.79 TSHR (0.50) LMNACA1CA2SMN1; SMN2ALDH1A1
SCHEMBL28568682 0.79 TSHR (0.50) LMNACA1CA2SMN1; SMN2ALDH1A1
SCHEMBL23849011 0.76 LTA4H (0.47) LMNA
SCHEMBL13033618 0.76 LMNA (0.39) LMNACA1CA2SMN1; SMN2ALDH1A1
SCHEMBL6988170 0.74 L3MBTL1 (0.50) LMNACA1CA2ALDH1A1ZDHHC7
Hydrochloric Acid SCHEMBL30420218 0.74 LTA4H (0.46) LMNACA1CA2
SCHEMBL2166892 0.74
SCHEMBL27720640 0.72 LMNA (0.43) LMNAALDH1A1MAPTMMP2MMP9
SCHEMBL2376555 0.72 FOLH1 (0.45) CA1CA2SMN1; SMN2ZDHHC7TSHR
SCHEMBL8705553 0.71 SMN1; SMN2 (0.37) CA1CA2SMN1; SMN2ZDHHC7MAPT

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-0390693-B1 THIOFORMAMIDE DERIVATIVES RHONE-POULENC SANTE (FR) 1993-08-25 EP claimed