SCHEMBL1604840

SCHEMBL1604840

CCC=CCC=CCC=CCC=CCC=CCCCC(=O)NCCSSCCNC(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 8/20 0.57
▸ ALDH1A1 P00352 3/20 0.47
▸ FAAH O00519 2/20 0.47
▸ CNR2 P34972 2/20 0.47
▸ TRPM8 Q7Z2W7 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KCNK3 O14649 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ TRPV1 Q8NER1 1/20 0.47
▸ MAPT P10636 2/20 0.47
▸ EPHX2 P34913 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ ALOX12 P18054 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL12722380 1.00 CNR1 (0.57) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL12685098 0.93 CNR1 (0.56) CNR1ALDH1A1FAAHCNR2MAPT
SCHEMBL15700831 0.92 CNR1 (0.64) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL12478623 0.88 CNR1 (0.73) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL14754937 0.86 CNR1 (0.60) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL12685101 0.85 CNR1 (0.69) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL2407680 0.84 CNR1 (0.62) CNR1ALDH1A1FAAHCNR2MAPT
SCHEMBL14752451 0.84 CNR1 (0.68) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL14752452 0.84 CNR1 (0.68) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL25835443 0.83 CNR1 (0.52) CNR1ALDH1A1FAAHCNR2TRPM8

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-20110082202-A1 FATTY ACID ACIFRAN DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2011-04-07 — — 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-20110082202-A1 FATTY ACID ACIFRAN DERIVATIVES AND THEIR USES FABP4, FASN, ELOVL6 CNR1 1599/4885ALDH1A1 936/4885FAAH 159/4885

“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.

Send feedback