SCHEMBL19628006

SCHEMBL19628006

CC(=O)N[C@@H]1CCN(Cc2cccc(CN3CCN(C(=O)OC(C)C(F)(F)F)CC3)c2C)C1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 13/20 0.45
CD274 Q9NZQ7 4/20 0.43
PLA2G7 Q13093 4/20 0.43
ABHD6 Q9BV23 4/20 0.43
PDCD1LG2 Q9BQ51 3/20 0.43
CCR2 P41597 1/20 0.41
CNR2 P34972 2/20 0.40

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
SCHEMBL19628004 1.00 MGLL (0.45) MGLLCD274PLA2G7ABHD6PDCD1LG2
SCHEMBL18087098 0.92 MGLL (0.54) MGLLPLA2G7ABHD6
SCHEMBL18087097 0.92 MGLL (0.54) MGLLPLA2G7ABHD6
SCHEMBL18064803 0.87 MGLL (0.56) MGLLPLA2G7ABHD6
SCHEMBL19628003 0.86 MGLL (0.51) MGLLPLA2G7ABHD6
SCHEMBL19627999 0.84 MGLL (0.52) MGLLPLA2G7ABHD6
SCHEMBL19628024 0.83 MGLL (0.57) MGLLPLA2G7ABHD6
SCHEMBL18064749 0.82 CD274 (0.50) CD274PDCD1LG2CCR2
SCHEMBL18064750 0.82 CD274 (0.50) CD274PDCD1LG2CCR2
SCHEMBL18064840 0.82 CD274 (0.50) CD274PDCD1LG2CCR2

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-20170334874-A1 PIPERAZINE CARBAMATES AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2017-11-23 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-20170334874-A1 PIPERAZINE CARBAMATES AND METHODS OF MAKING AND USING SAME ABHD6, RABL6, ABHD16A MGLL 46/4885CD274 4799/4885PLA2G7 204/4885

“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.