SCHEMBL4164642

SCHEMBL4164642

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nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CPB1 P15086 1/20 0.45
KIF11 P52732 3/20 0.41
ALDH1A1 P00352 2/20 0.38
CYP2C19 P33261 2/20 0.38
POLB P06746 2/20 0.38
CYP2C9 P11712 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BHMT Q93088 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
SLC1A1 P43005 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
SCHEMBL4164445 0.85 ALDH1A1 (0.43) CPB1KIF11ALDH1A1CYP2C19POLB
SCHEMBL20362609 0.82 CPB1 (0.49) CPB1KIF11ALDH1A1CYP2C19POLB
SCHEMBL1478672 0.82 CPB1 (0.49) CPB1KIF11ALDH1A1CYP2C19POLB
SCHEMBL20362608 0.82 CPB1 (0.49) CPB1KIF11ALDH1A1CYP2C19POLB
SCHEMBL4154758 0.82 CPB1 (0.49) CPB1KIF11ALDH1A1CYP2C19POLB
SCHEMBL16493607 0.77 NOD1 (0.43) BHMTSLC1A1
SCHEMBL22399771 0.76 CPB1 (0.39) CPB1ALDH1A1CYP2C19POLBCYP2C9
SCHEMBL416894 0.76 KMT2A (0.37) KIF11SMN1; SMN2KMT2ABHMTSLC1A1
SCHEMBL996039 0.76 KMT2A (0.37) KIF11SMN1; SMN2KMT2ABHMTSLC1A1
SCHEMBL6259101 0.76 KMT2A (0.37) KIF11SMN1; SMN2KMT2ABHMTSLC1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1933642-B1 SALT ENHANCING COMPOUNDS AND USE HOFMANN THOMAS FRANK (DE) 2011-12-21 EP disclosed
US-20090155440-A1 Salt Enhancing Compounds and Use GIVAUDAN SA (CH) 2009-06-18 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-20090155440-A1 Salt Enhancing Compounds and Use TAS1R1, TAS2R41, TAS2R40 CPB1 1244/4885KIF11 2751/4885ALDH1A1 2141/4885

“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.