SCHEMBL15548256

SCHEMBL15548256

COC(=O)C1(c2ccc3cc(OC)ccc3c2)CC1

nearest known ligand 0.75

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 2/20 0.45
MAPK1 P28482 1/20 0.45
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ABL1 P00519 1/20 0.44
OPRM1 P35372 1/20 0.43
PTGS1 P23219 3/20 0.43
AKR1C3 P42330 3/20 0.43
AKR1C2 P52895 3/20 0.43
PTGS2 P35354 2/20 0.42
CDC42 P60953 1/20 0.42
RAC1 P63000 1/20 0.42
CYP1A2 P05177 1/20 0.42
TSHR P16473 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.42

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
SCHEMBL8584110 0.93 ALDH1A1 (0.51) KDM4EALDH1A1MAPK1LMNA
SCHEMBL11462401 0.86 LMNA (0.48) KDM4EALDH1A1MAPK1LMNAOPRM1
SCHEMBL7744850 0.86 OPRM1 (0.56) OPRM1
SCHEMBL15546631 0.86 KDM4E (0.51) KDM4EALDH1A1LMNAPTGS1AKR1C3
SCHEMBL837139 0.85 ALDH1A1 (0.55) KDM4EALDH1A1MAPK1LMNASMN1; SMN2
SCHEMBL11467518 0.84 OPRM1 (0.46) KDM4EALDH1A1SMN1; SMN2OPRM1CYP1A2
SCHEMBL14710596 0.83 OPRM1 (0.42) ALDH1A1MAPK1LMNASMN1; SMN2OPRM1
SCHEMBL15912440 0.83 OPRM1 (0.42) ALDH1A1LMNASMN1; SMN2OPRM1
SCHEMBL14790321 0.83 OPRM1 (0.42) KDM4ELMNASMN1; SMN2ABL1OPRM1
SCHEMBL27736564 0.83 ADAM17 (0.56) ALDH1A1SMN1; SMN2OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150183737-A1 COMPOSITIONS AND METHODS FOR SUBSTRATE-SELECTIVE INHIBITION OF ENDOCANNABINOID OXYGENATION NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2015-07-02 US disclosed
WO-2014015341-A2 COMPOSITIONS AND METHODS FOR SUBSTRATE-SELECTIVE INHIBITION OF ENDOCANNABINOID OXYGENATION VANDERBILT UNIVERSITY (US) 2014-01-23 WO 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-20150183737-A1 COMPOSITIONS AND METHODS FOR SUBSTRATE-SELECTIVE INHIBITION OF ENDOCANNABINOID OXYGENATION CNR2, FAAH2, FAAH KDM4E 2302/4885ALDH1A1 983/4885MAPK1 4029/4885

“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.