SCHEMBL10044832

SCHEMBL10044832

NC(=O)CCC(CC(N)=O)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
KMT2A Q03164 1/20 0.44
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
FOLH1 Q04609 2/20 0.34
DPP4 P27487 1/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP9 Q86TI2 1/20 0.32
BMP1 P13497 1/20 0.32

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
SCHEMBL7026289 0.81 ALOX15 (0.41) ALOX15BLMPMP22KMT2ACA1
SCHEMBL293079 0.81 CA1 (0.39) ALOX15BLMPMP22KMT2ACA1
SCHEMBL28842913 0.80 CA1 (0.37) ALOX15BLMPMP22KMT2ACA1
SCHEMBL11694381 0.80 ALOX15 (0.44) ALOX15BLMPMP22KMT2ACA1
SCHEMBL1230306 0.80 CA1 (0.37) ALOX15BLMPMP22KMT2ACA1
SCHEMBL28650038 0.79 SLC1A3 (0.41) ALOX15BLMPMP22KMT2ACA1
SCHEMBL28601320 0.78 CA1 (0.37) ALOX15BLMPMP22CA1CA2
SCHEMBL6369370 0.78 ALOX15 (0.43) ALOX15BLMPMP22KMT2ACA1
SCHEMBL21906568 0.78 CA2 (0.61) ALOX15BLMPMP22KMT2ACA1
SCHEMBL9814736 0.78 FOLH1 (0.46) ALOX15BLMPMP22KMT2ACA1

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-8124806-B2 Contrast agents GE HEALTHCARE AS (NO) 2012-02-28 US disclosed
US-8124806-B2 Contrast agents GE HEALTHCARE AS (NO) 2012-02-28 US disclosed
US-20090053142-A1 CONTRAST AGENTS WYNN DUNCAN 2009-02-26 US disclosed
US-20090053142-A1 CONTRAST AGENTS WYNN DUNCAN 2009-02-26 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-20090053142-A1 CONTRAST AGENTS IPO4, TPO, IPO11 ALOX15 634/4885BLM 2953/4885PMP22 3519/4885

“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.