SCHEMBL3294692

SCHEMBL3294692

CN1CCOc2nc(Cl)c(Cl)nc21

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 3/20 0.34
▸ KDM4E B2RXH2 1/20 0.30
▸ ATM Q13315 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
SCHEMBL9379645 0.73 HTR1A (0.34) GRM5KDM4EATM
SCHEMBL19199980 0.70 KDM4E (0.42) GRM5KDM4EATM
SCHEMBL24373050 0.70 KDM4E (0.32) GRM5KDM4EATM
SCHEMBL25029143 0.66 GRM5 (0.40) GRM5
SCHEMBL25244746 0.66 GRM5 (0.54) GRM5
SCHEMBL29364626 0.66 GRM5 (0.40) GRM5
SCHEMBL2669132 0.65 ALPL (0.41) GRM5KDM4EATM
SCHEMBL16692823 0.65 SMN1; SMN2 (0.43) GRM5KDM4EATM
SCHEMBL21052924 0.63 GRM5 (0.42) GRM5
SCHEMBL31519294 0.62 GRM5 (0.36) GRM5KDM4EATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100266539-A1 CHEMOKINE RECEPTOR ANTAGONIST AND MEDICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2010-10-21 — — US disclosed
US-7732442-B2 Chemokine receptor antagonist and medical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2010-06-08 — — US disclosed
US-20070254886-A1 Chemokine Receptor Antagonist and Medical Use Thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 — — US disclosed
EP-1661889-A1 CHEMOKINE RECEPTOR ANTAGONIST AND MEDICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-05-31 — — EP disclosed
US-4029657-A MICROBIOCIDAL, HERBICIDAL OR INSECTICIDAL INTERMEDIATES THE DOW CHEMICAL COMPANY (US) 1977-06-14 — — 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 (2 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-20100266539-A1 CHEMOKINE RECEPTOR ANTAGONIST AND MEDICAL USE THEREOF CCR5, CCR4, CCR1 GRM5 1069/4885KDM4E 4430/4885ATM 2775/4885
US-20070254886-A1 Chemokine Receptor Antagonist and Medical Use Thereof CCR5, CCR4, CCR1 GRM5 1069/4885KDM4E 4430/4885ATM 2775/4885

“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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