SCHEMBL31205938

SCHEMBL31205938

CC(C)(C)OC(=O)NC1CCC(Nc2cccc3ccccc23)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.51
▸ MAOB P27338 1/20 0.51
▸ EPHX1 P07099 2/20 0.48
▸ DRD2 P14416 4/20 0.46
▸ EPHX2 P34913 1/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ CKS1B P61024 1/20 0.44
▸ SKP1 P63208 1/20 0.44
▸ SKP2 Q13309 1/20 0.44
▸ BTK Q06187 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ KCNA3 P22001 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ DRD3 P35462 1/20 0.42
▸ CCKBR P32239 1/20 0.42
▸ HPGD P15428 1/20 0.42

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
SCHEMBL5664378 0.86 ROCK2 (0.61) —
SCHEMBL5665109 0.86 ROCK2 (0.61) —
SCHEMBL5664368 0.86 ROCK2 (0.61) —
SCHEMBL15599599 0.83 KDM1A (0.54) KDM1AMAOBDRD2EPHX2CKS1B
SCHEMBL15289109 0.82 KDM1A (0.53) KDM1AMAOBDRD2EPHX2KDM4E
SCHEMBL22587686 0.82 KDM1A (0.53) KDM1AMAOBDRD2EPHX2KDM4E
SCHEMBL13527772 0.82 KDM1A (0.53) KDM1AMAOBDRD2EPHX2KDM4E
SCHEMBL19284706 0.80 CKS1B (0.57) KDM1AMAOBDRD2EPHX2CKS1B
SCHEMBL25011527 0.80 KDM1A (0.51) KDM1AMAOBDRD2EPHX2CKS1B
SCHEMBL31336610 0.80 KDM1A (0.48) KDM1AMAOBDRD2EPHX2CKS1B

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 1 patent. 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

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 KDM1A 3776/4885MAOB 1677/4885EPHX1 1233/4885

“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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