SCHEMBL25324305

SCHEMBL25324305

Fc1ccc(CN2CC3(CNC3)C2)c(F)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ CFTR P13569 5/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ PDCD1LG2 Q9BQ51 1/20 0.39
▸ CD274 Q9NZQ7 1/20 0.39
▸ BCHE P06276 2/20 0.39
▸ ACHE P22303 2/20 0.39
▸ BACE1 P56817 2/20 0.39
▸ CXCR3 P49682 1/20 0.38
▸ DRD2 P14416 2/20 0.38
▸ DRD1 P21728 1/20 0.38
▸ IDO1 P14902 2/20 0.38
▸ AGXT P21549 2/20 0.38
▸ HTR2A P28223 1/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37

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
SCHEMBL19262549 0.86 KDM4E (0.51) KDM4ESMN1; SMN2CFTRALDH1A1HDAC6
SCHEMBL19262568 0.86 KDM4E (0.58) KDM4ESMN1; SMN2CFTRALDH1A1
SCHEMBL23850552 0.85 ATM (0.46) KDM4ESMN1; SMN2ALDH1A1TDP1PDCD1LG2
SCHEMBL6927984 0.83 KDM4E (0.62) KDM4ESMN1; SMN2CFTRALDH1A1TDP1
SCHEMBL25145576 0.82 GPR183 (0.53) KDM4ESMN1; SMN2IDO1
SCHEMBL30490323 0.82 TSHR (0.44) KDM4ESMN1; SMN2HDAC6PDCD1LG2CD274
SCHEMBL31239639 0.77 SCN1A (0.38) KDM4ESMN1; SMN2ALDH1A1HDAC6PDCD1LG2
SCHEMBL30764740 0.77 CYP2D6 (0.45) KDM4EALDH1A1
SCHEMBL2924537 0.76 KDM4E (0.70) KDM4ESMN1; SMN2CFTRALDH1A1TDP1
SCHEMBL6927924 0.75 KDM4E (0.55) KDM4ESMN1; SMN2CFTRALDH1A1TDP1

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
US-20250099448-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-03-27 — — US disclosed
EP-4469446-A1 NEW HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-12-04 — — EP disclosed
US-20240199587-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2024-06-20 — — US disclosed
WO-2023144160-A1 NEW HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-08-03 — — WO 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-20240199587-A1 HETEROCYCLIC COMPOUNDS CYP1B1, CYP1A1, CYP4B1 KDM4E 1806/4885SMN1; SMN2 2783/4885CFTR 1445/4885
US-20250099448-A1 HETEROCYCLIC COMPOUNDS OPRM1, CYP1A1, CYP3A4 KDM4E 1137/4885SMN1; SMN2 2461/4885CFTR 3478/4885

“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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