SCHEMBL13845758

SCHEMBL13845758

CC[C@H]1CCC(C)=C[C@@H]1O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.33
OPRM1 P35372 7/20 0.33
HIF1A Q16665 3/20 0.33
EPAS1 Q99814 1/20 0.33
CNR1 P21554 9/20 0.33
GPR55 Q9Y2T6 4/20 0.32
TRPV1 Q8NER1 4/20 0.32
TRPM8 Q7Z2W7 3/20 0.32
TRPA1 O75762 2/20 0.32
TRPV3 Q8NET8 2/20 0.32
TRPV4 Q9HBA0 2/20 0.32
TRPV2 Q9Y5S1 2/20 0.32
CYP1A1 P04798 2/20 0.32
CYP2D6 P10635 2/20 0.32
CYP2B6 P20813 2/20 0.32
SLC6A2 P23975 2/20 0.32
CYP2C19 P33261 2/20 0.32
SLC6A3 Q01959 2/20 0.32
GPR6 P46095 1/20 0.32
NAAA Q02083 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
SCHEMBL22795135 1.00 CNR2 (0.33) CNR2OPRM1HIF1AEPAS1CNR1
SCHEMBL13845753 1.00 CNR2 (0.33) CNR2OPRM1HIF1AEPAS1CNR1
SCHEMBL4103087 0.77 AKR1C4 (0.39) HIF1AEPAS1TDP1
SCHEMBL13849730 0.77 AKR1C4 (0.39) HIF1AEPAS1TDP1
SCHEMBL4099629 0.77 AKR1C4 (0.39) HIF1AEPAS1TDP1
SCHEMBL4087942 0.76 ACE2 (0.35) TRPA1CYP2D6CYP2C19MEN1KMT2A
SCHEMBL5086014 0.71
Alcohol SCHEMBL4865871 0.69 LMNA (0.41) CNR2OPRM1HIF1AEPAS1CNR1
SCHEMBL23847917 0.69 CNR1 (0.53) CNR2OPRM1CNR1GPR55TRPV1
SCHEMBL20835188 0.69 CNR1 (0.53) CNR2OPRM1CNR1GPR55TRPV1

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-20090118157-A1 Processes For Production Of Wine Lactone And Its Intermediates And Application Of The Lactone SAN-EI GEN F.F.I. INC. (JP) 2009-05-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090118157-A1 Processes For Production Of Wine Lactone And Its Intermediates And Application Of The Lactone DCXR, COASY, AKR7A2 CNR2 3029/4885OPRM1 4851/4885HIF1A 3900/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.