SCHEMBL448795

SCHEMBL448795

COC(=O)CC1(N[S+]([O-])C(C)(C)C)CC(C)(C)Cc2ccc(Br)cc21

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL27268924 0.79 HPGD (0.33) HPGDKDM4EALDH1A1
SCHEMBL2374738 0.77 CYP2C9 (0.33) HPGDKDM4EALDH1A1
SCHEMBL27269104 0.75 SMN1; SMN2 (0.33) HPGDKDM4EMEN1ALDH1A1KMT2A
SCHEMBL27269071 0.75 SMN1; SMN2 (0.33) HPGDKDM4EMEN1ALDH1A1KMT2A
SCHEMBL445583 0.74 APP (0.35) HPGDKDM4EMEN1ALDH1A1KMT2A
SCHEMBL15434719 0.74 BACE1 (0.47)
SCHEMBL1465368 0.74 BACE1 (0.47)
SCHEMBL28941461 0.74 CHRNA7 (0.35) KMT2A
SCHEMBL28749072 0.74 CHRNA7 (0.35) KMT2A
SCHEMBL29689597 0.74 CHRNA7 (0.35) KMT2A

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-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. 2012-03-15 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-20120065195-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES APP, BACE1, PSEN1 HPGD 303/4885KDM4E 4178/4885MEN1 1819/4885

“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.