SCHEMBL29311813

SCHEMBL29311813

CCCCCCC(C)OC(=O)C1CC2CC1C1C3CCC(C3)C21

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
ALDH1A1 P00352 1/20 0.38
NAAA Q02083 1/20 0.38
ACE2 Q9BYF1 1/20 0.35
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GPR84 Q9NQS5 3/20 0.32
FFAR1 O14842 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
SCHEMBL29311842 0.80 POLB (0.31)
SCHEMBL29311816 0.80 CHRM2 (0.40) NAAA
SCHEMBL5525164 0.76 FAAH (0.49) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL12925856 0.76 FAAH (0.49) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL9283997 0.74 FAAH (0.46) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL5525161 0.74 FAAH (0.44) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL5519717 0.74 FAAH (0.44) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL5521301 0.74 FAAH (0.44) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL5531142 0.74 FAAH (0.44) FAAHCNR1CNR2ALDH1A1NAAA
SCHEMBL5521442 0.74 FAAH (0.44) FAAHCNR1CNR2ALDH1A1NAAA

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-20240228412-A1 PRODUCTION METHOD FOR PRODUCING DIMETHANOL COMPOUND HAVING NORBORNANE SKELETON MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2024-07-11 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-20240228412-A1 PRODUCTION METHOD FOR PRODUCING DIMETHANOL COMPOUND HAVING NORBORNANE SKELETON DHCR7, DBH, ADH5 FAAH 460/4885CNR1 887/4885CNR2 664/4885

“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.