SCHEMBL25933701

SCHEMBL25933701

COC(=O)c1cnc(N2CC3(CC(O)C3)C2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 3/20 0.41
VNN1 O95497 1/20 0.38
OXTR P30559 2/20 0.38
AVPR1A P37288 2/20 0.38
P2RY12 Q9H244 2/20 0.37
AVPR2 P30518 2/20 0.37
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
ABL1 P00519 2/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
PDGFRB P09619 1/20 0.35
KDR P35968 1/20 0.35
ATM Q13315 1/20 0.34

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
SCHEMBL25933699 0.91 OPRK1 (0.41) OPRK1OXTRAVPR1AP2RY12AVPR2
SCHEMBL25333905 0.87 NR1H2 (0.39) OPRK1OXTRAVPR1AP2RY12AVPR2
SCHEMBL31121722 0.84 OPRK1 (0.44) OPRK1P2RY12NR1H2NR1H3ABL1
SCHEMBL19689526 0.84 OPRK1 (0.44) OPRK1P2RY12NR1H2NR1H3ABL1
SCHEMBL24214266 0.81 OPRK1 (0.53) OPRK1P2RY12ABL1
SCHEMBL25333591 0.81 MAPK1 (0.35) OPRK1NR1H2NR1H3POLBMAPT
SCHEMBL24215693 0.79 OPRK1 (0.45) OPRK1P2RY12MAPTHDAC6
SCHEMBL30516578 0.79 OPRK1 (0.45) OPRK1P2RY12MAPTHDAC6
SCHEMBL4131161 0.78 OPRK1 (0.51) OPRK1P2RY12MAPTHDAC6
SCHEMBL19689497 0.77 OPRK1 (0.42) OPRK1P2RY12NR1H2NR1H3POLB

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-20230250106-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 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-20230250106-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 OPRK1 1823/4885VNN1 4826/4885OXTR 4117/4885

“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.