SCHEMBL20006316

SCHEMBL20006316

CCCCCCC(C)(CCCC)c1nnc(O)o1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 6/20 0.31
CNR1 P21554 2/20 0.31
CNR2 P34972 2/20 0.31
FDPS P14324 8/20 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
SCHEMBL21233371 0.86 TSHR (0.33) GGPS1CNR2FDPS
SCHEMBL26742610 0.86 TSHR (0.33) GGPS1CNR2FDPS
SCHEMBL21784193 0.86 TSHR (0.33) GGPS1CNR2FDPS
SCHEMBL26742748 0.86 TSHR (0.33) GGPS1CNR2FDPS
SCHEMBL23456878 0.86 TSHR (0.33) GGPS1CNR2FDPS
SCHEMBL26456152 0.81 CNR2 (0.30) CNR1CNR2
SCHEMBL18862706 0.80 HRH2 (0.32) CNR1CNR2
SCHEMBL26742323 0.79 CNR2 (0.34) GGPS1CNR1CNR2FDPS
SCHEMBL25101423 0.77
SCHEMBL22951340 0.75

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-10519125-B2 Flavagline derivatives PIERRE FABRE MEDICAMENT (FR) 2019-12-31 US disclosed
US-20180086729-A1 FLAVAGLINE DERIVATIVES PIERRE FABRE MEDICAMENT (FR) 2018-03-29 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 (2 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-20180086729-A1 FLAVAGLINE DERIVATIVES GCG, GCGR, KRAS GGPS1 702/4885CNR1 1435/4885CNR2 1295/4885
US-10519125-B2 Flavagline derivatives GCG, GCGR, KRAS GGPS1 702/4885CNR1 1435/4885CNR2 1295/4885

“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.