SCHEMBL29318638

SCHEMBL29318638

Cn1nc(-c2noc([C@]34CC[C@](CNC(=O)c5cc(F)c(O)c(F)c5F)(CC3)CC4)n2)ccc1=O

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 6/20 0.34
ADORA2A P29274 1/20 0.31
HSD11B1 P28845 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
SCHEMBL27213732 1.00 NR1H4 (0.34) NR1H4ADORA2AHSD11B1
SCHEMBL29318604 0.90 NR1H4 (0.35) NR1H4ADORA2AHSD11B1
SCHEMBL27213913 0.90 NR1H4 (0.35) NR1H4ADORA2AHSD11B1
SCHEMBL27394934 0.84 P2RX7 (0.39) NR1H4
SCHEMBL30849221 0.83 P2RX7 (0.39) NR1H4HSD11B1
SCHEMBL27213713 0.83 P2RX7 (0.39) NR1H4HSD11B1
SCHEMBL27392402 0.83 P2RX7 (0.39) NR1H4HSD11B1
SCHEMBL30892896 0.82 NR1H4 (0.35) NR1H4HSD11B1
SCHEMBL29318677 0.82 NR1H4 (0.35) NR1H4HSD11B1
SCHEMBL27213791 0.82 NR1H4 (0.35) NR1H4HSD11B1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240238425-A1 HSD17B13 Inhibitors and/or Degraders PFIZER INC. (US) 2024-07-18 US disclosed
US-20240238425-A1 HSD17B13 Inhibitors and/or Degraders PFIZER INC. (US) 2024-07-18 US disclosed
US-20240238425-A1 HSD17B13 Inhibitors and/or Degraders PFIZER INC. (US) 2024-07-18 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-20240238425-A1 HSD17B13 Inhibitors and/or Degraders HSD17B13, HSD17B3, HSD17B1 NR1H4 94/4885ADORA2A 4343/4885HSD11B1 9/4885

“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.