SCHEMBL11101486

SCHEMBL11101486

[CH2]CN1CCCCC1CCO

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TERT O14746 3/20 0.39
ALDH1A1 P00352 2/20 0.39
ALOX15 P16050 2/20 0.39
TSHR P16473 1/20 0.36
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35
S1PR5 Q9H228 1/20 0.35
LMNA P02545 1/20 0.34
VEGFA P15692 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
AKR1C3 P42330 1/20 0.33
CYP1A2 P05177 1/20 0.32
SIGMAR1 Q99720 2/20 0.32
OPRK1 P41145 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL9044441 0.94 VEGFA (0.37) TERTALDH1A1ALOX15TSHRS1PR1
SCHEMBL3429412 0.82 TERT (0.46) TERTALDH1A1ALOX15TSHRS1PR1
SCHEMBL3429301 0.82 TERT (0.46) TERTALDH1A1ALOX15TSHRS1PR1
SCHEMBL3429337 0.82 TERT (0.46) TERTALDH1A1ALOX15TSHRS1PR1
SCHEMBL6628592 0.82 ALDH1A1 (0.44) TERTALDH1A1ALOX15TSHRS1PR1
SCHEMBL3430851 0.78 S1PR1 (0.47) TERTALDH1A1ALOX15S1PR1S1PR3
SCHEMBL3424382 0.78 S1PR1 (0.47) TERTALDH1A1ALOX15S1PR1S1PR3
Iodide SCHEMBL22034493 0.78 TERT (0.39) TERTALDH1A1ALOX15TSHRS1PR1
SCHEMBL3431907 0.78 S1PR1 (0.47) TERTALDH1A1ALOX15S1PR1S1PR3
SCHEMBL3429336 0.77 TERT (0.46) TERTALDH1A1ALOX15TSHRS1PR1

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
US-4486471-A WATER-INSOLUBLE, ACID-SOLUBLE POLYMER TANABE SEIYAKU CO., LTD. (JP) 1984-12-04 US disclosed