SCHEMBL4084509

SCHEMBL4084509

CC/C=C(\C(=O)O)N1CCCC1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
INMT O95050 1/20 0.40
KMT2A Q03164 3/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA13 Q8N1Q1 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
BLM P54132 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38

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
SCHEMBL3823540 1.00 LMNA (0.49) LMNAINMTKMT2ACA12CA1
SCHEMBL3858131 1.00 LMNA (0.49) LMNAINMTKMT2ACA12CA1
SCHEMBL3826928 0.87 LMNA (0.46) LMNAINMTKMT2ACA12CA1
SCHEMBL14644848 0.83 LMNA (0.45) LMNAKMT2ACA12CA1CA2
SCHEMBL3378778 0.82 LMNA (0.50) LMNAINMTKMT2ACA12CA1
SCHEMBL3378768 0.82 LMNA (0.50) LMNAINMTKMT2ACA12CA1
SCHEMBL3378771 0.82 LMNA (0.50) LMNAINMTKMT2ACA12CA1
SCHEMBL4607217 0.81 LMNA (0.46) LMNAINMTKMT2ABLMKDM4E
SCHEMBL1737650 0.77 LMNA (0.48) LMNAINMTKMT2ACA12CA1
SCHEMBL1737652 0.77 LMNA (0.48) LMNAINMTKMT2ACA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035464-A1 1,2-DITHIOL-3-THIONES AS CHAIN-TRANSFER AGENTS IN FREE-RADICAL POLYMERIZATION REACTIONS BASF SE (DE) 2009-03-18 EP disclosed
WO-2007147857-A1 1,2-DITHIOL-3-THIONES AS CHAIN-TRANSFER AGENTS IN FREE-RADICAL POLYMERIZATION REACTIONS BASF SE (DE) 2007-12-27 WO disclosed
US-6232273-B1 MACROMOLECULAR COMPOUND WITH NITROGEN-CONTAINING RING PENDANT TO THE POLYMER CHAIN, SUCH AS POLYMER OF (METH)ACRYLOYL PYRROLIDINE, PYRROLIDINOCARBONYLETHYL (METH)ACRYLATE, 2-OXO-PYRROLIDINO-ETHYL (METH)ACRYLATE, ETC. NIPPON SHOKUBAI CO., LTD. (JP) 2001-05-15 US disclosed
EP-0828778-A1 CLATHRATE HYDRATE INHIBITOR AND METHOD OF INHIBITING THE FORMATION OF CLATHRATE HYDRATES USING IT NIPPON SHOKUBAI CO., LTD. (JP) 1998-03-18 EP disclosed
WO-1996038492-A1 CLATHRATE HYDRATE INHIBITOR AND METHOD OF INHIBITING THE FORMATION OF CLATHRATE HYDRATES USING IT NIPPON SHOKUBAI CO., LTD. (JP) 1996-12-05 WO disclosed