SCHEMBL29559656

SCHEMBL29559656

O=C(O)c1cnc2c(c1)C[C@@]1(C2)C(=O)Nc2ncccc21

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CALCRL Q16602 20/20 0.61
RAMP1 O60894 8/20 0.55

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
SCHEMBL31084957 1.00 CALCRL (0.61) CALCRLRAMP1
SCHEMBL14933346 1.00 CALCRL (0.61) CALCRLRAMP1
SCHEMBL3694253 1.00 CALCRL (0.61) CALCRLRAMP1
SCHEMBL29518081 1.00 CALCRL (0.61) CALCRLRAMP1
SCHEMBL29997203 1.00 CALCRL (0.61) CALCRLRAMP1
Hydrochloric Acid SCHEMBL31126002 0.99 CALCRL (0.60) CALCRLRAMP1
Water SCHEMBL29518115 0.99 CALCRL (0.60) CALCRLRAMP1
SCHEMBL4567288 0.90 CALCRL (0.58) CALCRLRAMP1
SCHEMBL4571727 0.87 CALCRL (0.58) CALCRLRAMP1
SCHEMBL31126005 0.87 CALCRL (0.58) CALCRLRAMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4653049-A2 CGRP ANTAGONIST COMPOUNDS Nxera Pharma UK Limited (GB) 2025-11-26 EP disclosed
EP-3983417-B1 CGRP ANTAGONIST COMPOUNDS NXERA PHARMA UK LTD (GB) 2025-09-03 EP disclosed
US-20250136616-A1 CGRP ANTAGONIST COMPOUNDS HEPTARES THERAPEUTICS LIMITED (GB) 2025-05-01 US disclosed
US-12227521-B2 CGRP antagonist compounds NXERA PHARMA UK LIMITED (GB) 2025-02-18 US disclosed
CN-114245797-B CGRP antagonist compounds 奈克斯拉制药英国有限公司 2024-09-17 CN disclosed
US-20220251110-A1 CGRP ANTAGONIST COMPOUNDS NXERA PHARMA UK LIMITED (GB) 2022-08-11 US disclosed
EP-3983417-A1 CGRP ANTAGONIST COMPOUNDS Heptares Therapeutics Limited (GB) 2022-04-20 EP 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-20220251110-A1 CGRP ANTAGONIST COMPOUNDS CALCRL, CALCR, OPRL1 CALCRL 1/4885RAMP1 49/4885
US-20250136616-A1 CGRP ANTAGONIST COMPOUNDS CALCRL, CALCR, OPRL1 CALCRL 1/4885RAMP1 49/4885
US-12227521-B2 CGRP antagonist compounds CALCRL, CALCR, OPRL1 CALCRL 1/4885RAMP1 49/4885

“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.