SCHEMBL25039457

SCHEMBL25039457

Cc1cc(C)c(NC2CCC(CN)CC2)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RAPGEF4 Q8WZA2 9/20 0.42
▸ LMNA P02545 1/20 0.38
▸ BTK Q06187 1/20 0.36
▸ CRHR1 P34998 4/20 0.36
▸ KDM1A O60341 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ KMT2A Q03164 1/20 0.35
▸ DYRK1A Q13627 1/20 0.34
▸ MELK Q14680 1/20 0.34
▸ PIM1 P11309 1/20 0.33
▸ PIM2 Q9P1W9 1/20 0.33

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
SCHEMBL25039416 0.80 RAPGEF4 (0.46) RAPGEF4KDM1A
SCHEMBL20353195 0.78 RAPGEF4 (0.48) RAPGEF4
SCHEMBL25039645 0.77 BTK (0.37) BTKKDM1AMAOBDYRK1AMELK
SCHEMBL20353196 0.76 TAS1R3 (0.51) RAPGEF4LMNAKMT2A
SCHEMBL25041513 0.73 ALDH1A1 (0.43) LMNABTKKDM1AMAOB
SCHEMBL30279242 0.73 ALDH1A1 (0.43) LMNABTKKDM1AMAOB
SCHEMBL1842397 0.73 RAPGEF4 (0.46) RAPGEF4KDM1AKMT2A
SCHEMBL2094375 0.73 RAPGEF4 (0.46) RAPGEF4KMT2A
SCHEMBL31619851 0.71 RAPGEF4 (0.48) RAPGEF4
SCHEMBL29218718 0.70 TAS1R3 (0.37) RAPGEF4LMNAKMT2A

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-20240360114-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2024-10-31 — — US disclosed
EP-4384493-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd (KY) 2024-06-19 — — EP disclosed
CN-118076581-A Iron death modulators, their preparation and use 维泰瑞隆有限公司 2024-05-24 — — CN disclosed
WO-2023016447-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-02-16 — — WO disclosed
WO-2023016447-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-02-16 — — 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 (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-20240360114-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF AIFM2, GPX1, GPX4 RAPGEF4 966/4885LMNA 1809/4885BTK 3650/4885

“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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