SCHEMBL10267499

SCHEMBL10267499

CCOC(=O)CC(NC(=O)c1cc(C(=O)O)n[nH]1)c1ccc(-c2cccc(Cl)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 6/20 0.51
▸ CTSA P10619 3/20 0.46
▸ MMEL1 Q495T6 1/20 0.45
▸ TP53 P04637 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ DCAF1 Q9Y4B6 2/20 0.43
▸ MAPT P10636 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ CDK2 P24941 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ MAPK10 P53779 1/20 0.40
▸ ROCK2 O75116 1/20 0.40

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
SCHEMBL2872605 0.86 MME (0.64) MMEMMEL1
SCHEMBL18672760 0.79 MME (0.73) MMEMMEL1
SCHEMBL12317383 0.79 MME (0.73) MMEMMEL1
SCHEMBL10260899 0.78 MMEL1 (0.50) MMECTSAMMEL1TP53THRB
SCHEMBL10197750 0.78 MMEL1 (0.58) MMEMMEL1
SCHEMBL16132552 0.77 MME (0.60) MME
SCHEMBL10259960 0.77 MMEL1 (0.48) MMECTSAMMEL1TP53THRB
SCHEMBL2875465 0.76 MMEL1 (0.58) MMEMMEL1
SCHEMBL2875464 0.76 MMEL1 (0.58) MMEMMEL1
SCHEMBL12975592 0.76 MME (0.53) MMEMMEL1

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-20120122844-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY NOVARTIS AG (CH) 2012-05-17 — — 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-20120122844-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY REN, SERPINB1, MME MME 3/4885CTSA 105/4885MMEL1 118/4885

“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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