SCHEMBL14433876

SCHEMBL14433876

CCCC(=N)N1CCOCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.42
TSHR P16473 2/20 0.42
LMNA P02545 3/20 0.41
POLB P06746 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 3/20 0.40
PDK1 Q15118 2/20 0.40
PDK2 Q15119 2/20 0.40
PDK3 Q15120 2/20 0.40
FAAH O00519 1/20 0.40
PHGDH O43175 1/20 0.40
ALDH2 P05091 1/20 0.40
MGLL Q99685 1/20 0.40
RECQL P46063 1/20 0.39
RAB9A P51151 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RXFP1 Q9HBX9 1/20 0.37
GLA P06280 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37

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
SCHEMBL12604562 0.82 HTT (0.45) HTTTSHRLMNAPOLBSMN1; SMN2
SCHEMBL10424339 0.80 LMNA (0.42) HTTTSHRLMNAPOLBSMN1; SMN2
SCHEMBL10424396 0.80 L3MBTL1 (0.42) HTTTSHRLMNASMN1; SMN2ALDH1A1
SCHEMBL10424394 0.78 LMNA (0.41) HTTTSHRLMNAPOLBSMN1; SMN2
SCHEMBL10424341 0.78 LMNA (0.45) HTTTSHRLMNASMN1; SMN2ALDH1A1
SCHEMBL14433874 0.77 F2 (0.48) ALDH1A1PHGDHALDH2MGLLL3MBTL1
SCHEMBL14434063 0.76 MGLL (0.41) ALDH1A1PHGDHMGLLRAB9A
SCHEMBL14434111 0.74 HSD11B1 (0.39) SMN1; SMN2ALDH1A1
SCHEMBL84372 0.74 TSHR (0.62) HTTTSHRLMNAPOLBSMN1; SMN2
SCHEMBL19446412 0.73 LMNA (0.43) HTTTSHRLMNASMN1; SMN2ALDH1A1

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
WO-2007087204-A2 HETEROCYCLES AS NICOTINIC ACID RECEPTOR AGONISTS FOR THE TREATMENT OF DYYSLIPIDEMIA SCHERING CORPOORATION (US) 2007-08-02 WO disclosed