SCHEMBL29954831

SCHEMBL29954831

Cc1cccc(B(O)O)c1OCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPE Q05469 1/20 0.62
▸ HTR1A P08908 2/20 0.52
▸ ADRA1D P25100 2/20 0.52
▸ ADRA1A P35348 2/20 0.52
▸ ADRA1B P35368 2/20 0.52
▸ PTGER4 P35408 4/20 0.51
▸ PTGER3 P43115 4/20 0.51
▸ PTGER2 P43116 4/20 0.51
▸ PTGER1 P34995 2/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ KMT2A Q03164 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ ENPP2 Q13822 1/20 0.48
▸ SCN4A P35499 1/20 0.47
▸ SCN8A Q9UQD0 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ PTPN1 P18031 1/20 0.46
▸ RXRA P19793 1/20 0.43

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
SCHEMBL18716386 0.89 HTR1A (0.61) LIPEHTR1AADRA1DADRA1AADRA1B
SCHEMBL19830914 0.85 LIPE (0.60) LIPEHTR1AADRA1DADRA1AADRA1B
SCHEMBL29958452 0.83 LIPE (0.58) LIPEHTR1AADRA1DADRA1AADRA1B
SCHEMBL29691238 0.83 LIPE (0.58) LIPEHTR1AADRA1DADRA1AADRA1B
SCHEMBL28286357 0.83 LIPE (0.58) LIPEHTR1AADRA1DADRA1AADRA1B
SCHEMBL23210246 0.83 LIPE (0.58) LIPEHTR1AADRA1DADRA1AADRA1B
SCHEMBL3413503 0.82 LIPE (0.66) LIPEHTR1AADRA1DADRA1AADRA1B
SCHEMBL257590 0.81 LIPE (0.56) LIPEHTR1AADRA1DADRA1AADRA1B
SCHEMBL16180183 0.81 LIPE (0.55) LIPEHTR1AADRA1DADRA1AADRA1B
SCHEMBL6904905 0.81 PTGER4 (0.56) LIPEHTR1AADRA1DADRA1AADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4720076-A1 SPIROMACROCYCLIC OREXIN 2 RECEPTOR AGONISTS H. Lundbeck A/S (DK) 2026-04-08 — — EP disclosed
US-12590106-B2 Spiromacrocyclic orexin 2 receptor agonists H. LUNDBECK A/S (DK) 2026-03-31 — — US disclosed
US-20250263422-A1 SPIROMACROCYCLIC OREXIN 2 RECEPTOR AGONISTS H. LUNDBECK A/S (DK) 2025-08-21 — — US disclosed
US-20240425521-A1 SPIROMACROCYCLIC OREXIN 2 RECEPTOR AGONISTS H. LUNDBECK A/S (DK) 2024-12-26 — — US disclosed
WO-2024246285-A1 SPIROMACROCYCLIC OREXIN 2 RECEPTOR AGONISTS H. LUNDBECK A/S (DK) 2024-12-05 — — WO disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — 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 (3 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-12590106-B2 Spiromacrocyclic orexin 2 receptor agonists HCRTR2, HCRTR1, OXER1 LIPE 3059/4885HTR1A 4/4885ADRA1D 45/4885
US-20250263422-A1 SPIROMACROCYCLIC OREXIN 2 RECEPTOR AGONISTS HCRTR2, HCRTR1, CRHR2 LIPE 2910/4885HTR1A 156/4885ADRA1D 158/4885
US-20240425521-A1 SPIROMACROCYCLIC OREXIN 2 RECEPTOR AGONISTS HCRTR2, HCRTR1, CRHR2 LIPE 2910/4885HTR1A 156/4885ADRA1D 158/4885

“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.

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