SCHEMBL21897248

SCHEMBL21897248

CC[C@@H]1COC(=O)N1C(C)C

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.40
CNR2 P34972 1/20 0.32
PDE1A P54750 1/20 0.31
PDE1B Q01064 1/20 0.31
PDE1C Q14123 1/20 0.31
AR P10275 3/20 0.30
P2RX3 P56373 1/20 0.30
P2RX2 Q9UBL9 1/20 0.30
IL6ST P40189 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
SCHEMBL10308879 1.00 PIK3CD (0.40) PIK3CDCNR2PDE1APDE1BPDE1C
SCHEMBL23634006 1.00 PIK3CD (0.40) PIK3CDCNR2PDE1APDE1BPDE1C
SCHEMBL10308880 0.85 PIK3CD (0.38) PIK3CDCNR2IL6ST
SCHEMBL20989996 0.85 PIK3CD (0.40) PIK3CD
SCHEMBL22886416 0.83 PIK3CD (0.39) PIK3CD
SCHEMBL10308851 0.83 PIK3CD (0.42) PIK3CDAR
SCHEMBL23634013 0.83 PIK3CD (0.42) PIK3CDAR
SCHEMBL6639373 0.83 PIK3CD (0.39) PIK3CDIL6ST
SCHEMBL10308834 0.82 PIK3CD (0.36) PIK3CDAR
SCHEMBL23634009 0.77

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-20200123132-A1 ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC 2020-04-23 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-20200123132-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 PIK3CD 1022/4885CNR2 4830/4885PDE1A 4865/4885

“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.