SCHEMBL19604276

SCHEMBL19604276

CCN(CC)CCCC(C)(C)CCN(C)CCCC(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 1/20 0.31
FDPS P14324 1/20 0.31
AGTR1 P30556 1/20 0.31
OPRM1 P35372 1/20 0.31
PDE3A Q14432 1/20 0.31
CACNA2D1 P54289 1/20 0.31
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL22817570 0.93 GGPS1 (0.31) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL678643 0.82 SIGMAR1 (0.38) OPRM1CACNA2D1SIGMAR1
SCHEMBL20675493 0.79 ALDH1A1 (0.37) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL19705235 0.79 CHRM2 (0.45)
SCHEMBL19478585 0.79 CACNA2D1 (0.33) CACNA2D1SIGMAR1
SCHEMBL20664136 0.78 CHRM2 (0.32) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL22353248 0.77
SCHEMBL13649903 0.77 CHRM2 (0.36) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL17225210 0.77 CHRM2 (0.39) GGPS1FDPSAGTR1OPRM1PDE3A
SCHEMBL21937936 0.76 ALDH1A1 (0.36)

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-20170327448-A1 METHODS FOR PRODUCING FUELS, GASOLINE ADDITIVES, AND LUBRICANTS USING AMINE CATALYSTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-11-16 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-20170327448-A1 METHODS FOR PRODUCING FUELS, GASOLINE ADDITIVES, AND LUBRICANTS USING AMINE CATALYSTS GK, MSMO1, DGKG GGPS1 342/4885FDPS 1520/4885AGTR1 3265/4885

“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.