SCHEMBL6598455

SCHEMBL6598455

C=CC(=O)OC(C)C(=O)N1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.36
DPP4 P27487 5/20 0.35
DPP7 Q9UHL4 4/20 0.35
HTT P42858 2/20 0.35
MAPT P10636 1/20 0.35
ALOX12 P18054 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 1/20 0.34
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP8 P22894 1/20 0.33
TGM2 P21980 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
SCHEMBL18288705 0.85 ALDH1A1 (0.46) L3MBTL1LMNAALDH1A1KMT2ADPP4
SCHEMBL18288681 0.84 ALDH1A1 (0.46) L3MBTL1LMNAALDH1A1KMT2ADPP4
SCHEMBL6597962 0.78 MEN1 (0.38) L3MBTL1KMT2ATSHRDPP4DPP7
SCHEMBL19701743 0.78 ALDH1A1 (0.42) L3MBTL1LMNAALDH1A1KMT2ADPP4
SCHEMBL19701745 0.78 ALDH1A1 (0.42) L3MBTL1LMNAALDH1A1KMT2ADPP4
SCHEMBL25852051 0.77 L3MBTL1 (0.44) L3MBTL1LMNAALDH1A1KMT2ATSHR
SCHEMBL18288709 0.76 ALDH1A1 (0.43) L3MBTL1LMNAALDH1A1KMT2ASMN1; SMN2
SCHEMBL28614556 0.76 L3MBTL1 (0.43) L3MBTL1LMNAALDH1A1KMT2ATSHR
SCHEMBL28614554 0.76 L3MBTL1 (0.43) L3MBTL1LMNAALDH1A1KMT2ATSHR
SCHEMBL5661089 0.74 MMP1 (0.42) L3MBTL1LMNAALDH1A1KMT2ADPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828778-B1 CLATHRATE HYDRATE INHIBITOR AND METHOD OF INHIBITING THE FORMATION OF CLATHRATE HYDRATES USING IT NIPPON CATALYTIC CHEM IND (JP) 2004-05-12 EP 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