SCHEMBL20670899

SCHEMBL20670899

Cc1noc(-c2c(N3CCC4(CC3)OCCO4)nc3c(F)cc(OC(F)(F)F)cc3c2C)n1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 20/20 0.68
▸ OPRM1 P35372 5/20 0.55
▸ OPRD1 P41143 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49

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
SCHEMBL20670663 0.90 OPRK1 (0.67) OPRK1OPRM1
SCHEMBL29664164 0.90 OPRK1 (0.67) OPRK1OPRM1
SCHEMBL20670628 0.88 OPRK1 (0.64) OPRK1OPRM1
SCHEMBL20670932 0.86 OPRK1 (0.64) OPRK1OPRM1OPRD1KCNH2
SCHEMBL20499958 0.86 OPRK1 (0.65) OPRK1OPRM1OPRD1KCNH2
SCHEMBL20670528 0.85 OPRK1 (0.67) OPRK1OPRM1OPRD1KCNH2
SCHEMBL20670800 0.85 OPRK1 (0.65) OPRK1OPRM1OPRD1KCNH2
SCHEMBL20670513 0.84 OPRK1 (0.67) OPRK1OPRM1OPRD1KCNH2
SCHEMBL20670898 0.84 OPRK1 (0.69) OPRK1OPRM1OPRD1KCNH2
SCHEMBL20670939 0.84 OPRK1 (0.53) OPRK1OPRM1OPRD1KCNH2

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-3596069-B1 KAPPA OPIOID RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO SCRIPPS RESEARCH INST (US) 2022-07-13 — — EP disclosed
US-20220162202-A1 KAPPA OPIOID RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO Neumora Therapeutics, Inc. 2022-05-26 — — US disclosed
US-11124504-B2 Kappa opioid receptor antagonists and products and methods related thereto THE SCRIPPS RESEARCH INSTITUTE (US) 2021-09-21 — — US disclosed
US-20210047310-A1 KAPPA OPIOID RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO Neumora Therapeutics, Inc. 2021-02-18 — — US disclosed
US-10676469-B2 Kappa opioid receptor antagonists and products and methods related thereto BLACKTHORN THERAPEUTICS, INC. (US) 2020-06-09 — — US disclosed
US-20190023700-A1 KAPPA OPIOID RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO Neumora Therapeutics, Inc. 2019-01-24 — — 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 (5 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-20220162202-A1 KAPPA OPIOID RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO OPRK1, OPRD1, OPRM1 OPRK1 1/4885OPRM1 3/4885OPRD1 2/4885
US-11124504-B2 Kappa opioid receptor antagonists and products and methods related thereto OPRK1, OPRD1, OPRM1 OPRK1 1/4885OPRM1 3/4885OPRD1 2/4885
US-20190023700-A1 KAPPA OPIOID RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO OPRK1, OPRD1, OPRM1 OPRK1 1/4885OPRM1 3/4885OPRD1 2/4885
US-10676469-B2 Kappa opioid receptor antagonists and products and methods related thereto OPRK1, OPRD1, OPRM1 OPRK1 1/4885OPRM1 3/4885OPRD1 2/4885
US-20210047310-A1 KAPPA OPIOID RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO OPRK1, OPRD1, OPRM1 OPRK1 1/4885OPRM1 3/4885OPRD1 2/4885

“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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