SCHEMBL11658293

SCHEMBL11658293

O=C(OCC1CC1)c1ccon1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNA4 P43681 2/20 0.42
AR P10275 3/20 0.42
JMJD6 Q6NYC1 2/20 0.40
ACACB O00763 4/20 0.39
ADORA2B P29275 4/20 0.39
HIF1A Q16665 1/20 0.36
CNR2 P34972 1/20 0.35

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
SCHEMBL27880448 0.78 CHRNA4 (0.37) CHRNA4ARACACBCNR2
SCHEMBL1810135 0.76 CYP1A2 (0.55) ACACB
SCHEMBL11664017 0.75 CYP1A2 (0.58) JMJD6CNR2
SCHEMBL6619438 0.74 AR (0.57) CHRNA4ARHIF1A
SCHEMBL27544464 0.73 CHRNA4 (0.44) CHRNA4ARCNR2
SCHEMBL28135407 0.73
SCHEMBL28215407 0.73 CHRNA4 (0.41) CHRNA4ARACACBCNR2
SCHEMBL28232554 0.72 ALDH1A1 (0.50) JMJD6ACACBADORA2B
SCHEMBL11660732 0.72 JMJD6 (0.60) JMJD6
SCHEMBL28897674 0.71 L3MBTL1 (0.50)

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-4093622-A Pyridine esters of cyclopropane-carboxylic acid ZOECON CORPORATION (US) 1978-06-06 US disclosed