SCHEMBL7574075

SCHEMBL7574075

CCC(C)CC#CCOS(C)(=O)=O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MMP9 P14780 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL7573117 0.82 ALDH1A1 (0.36) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL499731 0.78 USP2 (0.48) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL576900 0.74 USP2 (0.40) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL11754274 0.71 KDM4E (0.37) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL7571703 0.71 ALDH1A1 (0.37) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL12445283 0.71 KDM4E (0.37) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL495979 0.70 CA1 (0.46) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL495977 0.70 CA1 (0.46) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL4211542 0.70 CA1 (0.46) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL6165681 0.70 USP2 (0.40) KDM4EUSP2ALDH1A1LMNAMMP9

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
EP-0810199-B1 Method for producing propargylamine compounds SUMITOMO CHEMICAL CO (JP) 2002-09-25 EP disclosed
US-5756769-A Method for producing propargylamine compounds SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1998-05-26 US disclosed
EP-0810199-A1 Method for producing propargylamine compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-03 EP disclosed