SCHEMBL5037475

SCHEMBL5037475

CC(C[PH](=O)O)C(=O)Nc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 1/20 0.56
▸ ACE P12821 1/20 0.56
▸ MEN1 O00255 4/20 0.51
▸ KMT2A Q03164 4/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ MAPT P10636 4/20 0.51
▸ LMNA P02545 2/20 0.51
▸ GAA P10253 1/20 0.51
▸ ATM Q13315 1/20 0.51
▸ RXFP1 Q9HBX9 1/20 0.51
▸ RAB9A P51151 3/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ POLB P06746 2/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ HPGD P15428 3/20 0.45
▸ HTT P42858 2/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ TAAR1 Q96RJ0 1/20 0.45
▸ HSP90AA1 P07900 1/20 0.45
▸ GPR55 Q9Y2T6 1/20 0.45

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
SCHEMBL5037047 0.85 MAPT (0.56) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL11663482 0.84 MME (0.54) MMEACEMEN1KMT2AALDH1A1
SCHEMBL4151615 0.79 MME (0.63) MMEACEMEN1KMT2AALDH1A1
SCHEMBL8027661 0.79 MME (0.63) MMEACEMEN1KMT2AALDH1A1
SCHEMBL12205972 0.79 MME (0.63) MMEACEMEN1KMT2AALDH1A1
SCHEMBL18456226 0.79 MME (0.63) MMEACEMEN1KMT2AALDH1A1
Benzene SCHEMBL7271414 0.77 ACE (0.61) MMEACEMEN1KMT2AALDH1A1
SCHEMBL16452816 0.77 MME (0.61) MMEACEMEN1KMT2AALDH1A1
SCHEMBL11770912 0.77 ACE (0.61) MMEACEMEN1KMT2AALDH1A1
SCHEMBL9761683 0.77 MME (0.61) MMEACEMEN1KMT2AALDH1A1

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-7345082-B2 Phosphinic acids HOFFMANN-LA ROCHE INC. (US) 2008-03-18 — — US disclosed
EP-1685142-A1 PHOSPHINIC ACID DERIVATIVES, BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2006-08-02 — — EP disclosed
WO-2005044830-A1 PHOSPHINIC ACIDS DERIVATIVES, BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER’S DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2005-05-19 — — WO disclosed
US-20050107341-A1 Phosphinic acids F. HOFFMANN-LA ROCHE AG (CH) 2005-05-19 — — 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-20050107341-A1 Phosphinic acids BACE1, PSEN1, PSEN2 MME 656/4885ACE 230/4885MEN1 550/4885

“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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