SCHEMBL25244277

SCHEMBL25244277

Nc1c(OC[C@H]2COCCO2)cc(F)nc1Br

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 12/20 0.38
▸ GPR84 Q9NQS5 5/20 0.35
▸ MKNK2 Q9HBH9 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPT P10636 1/20 0.34

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
SCHEMBL25216374 0.79 GRM4 (0.41) GRM4MKNK2
SCHEMBL25218862 0.79 GRM4 (0.41) GRM4MKNK2
SCHEMBL25208533 0.73 MKNK2 (0.40) GRM4GPR84MKNK2
SCHEMBL25212666 0.69 GRM4 (0.37) GRM4GPR84MKNK2ALDH1A1MAPT
SCHEMBL25212147 0.69 GRM4 (0.37) GRM4GPR84MKNK2ALDH1A1MAPT
SCHEMBL20203110 0.68 DRD4 (0.48) GPR84KDM4EALDH1A1LMNAMAPT
SCHEMBL28343422 0.68 DRD4 (0.48) GPR84KDM4EALDH1A1LMNAMAPT
SCHEMBL25212692 0.67 MBOAT4 (0.33) —
SCHEMBL15333669 0.66 AXL (0.53) —
SCHEMBL18832207 0.66 AXL (0.53) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4509122-A2 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF Bayer Aktiengesellschaft (DE) 2025-02-19 — — EP disclosed
EP-4188930-B1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF BAYER AG (DE) 2024-10-23 — — EP disclosed
US-20230391769-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2023-12-07 — — US disclosed
EP-4188930-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF Bayer Aktiengesellschaft (DE) 2023-06-07 — — 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 (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-20230391769-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THERAPEUTIC USES THEREOF CYP11B2, SDHA, UGT2B7 GRM4 3503/4885GPR84 2971/4885MKNK2 3524/4885

“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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