SCHEMBL25212147

SCHEMBL25212147

O=[N+]([O-])c1cnc(F)cc1OC[C@H]1COCCO1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 9/20 0.37
▸ GPR84 Q9NQS5 6/20 0.36
▸ MKNK2 Q9HBH9 1/20 0.35
▸ CHEK1 O14757 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 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
SCHEMBL25212666 1.00 GRM4 (0.37) GRM4GPR84MKNK2CHEK1ALDH1A1
SCHEMBL25216374 0.79 GRM4 (0.41) GRM4MKNK2
SCHEMBL25218862 0.79 GRM4 (0.41) GRM4MKNK2
SCHEMBL25208533 0.76 MKNK2 (0.40) GRM4GPR84MKNK2
SCHEMBL25214278 0.76 GRM5 (0.37) CHEK1ALDH1A1CYP1A2MAPTCYP2C9
SCHEMBL10892031 0.76 CYP1A2 (0.51) ALDH1A1CYP1A2CYP2C19
SCHEMBL6551120 0.74 GPR35 (0.41) ALDH1A1CYP1A2MAPTCYP2C9
SCHEMBL6550218 0.74 GPR35 (0.41) ALDH1A1CYP1A2MAPTCYP2C9
SCHEMBL1699894 0.73 LMNA (0.45) ALDH1A1MAPT
SCHEMBL1700083 0.73 LMNA (0.45) ALDH1A1MAPT

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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