SCHEMBL5323213

SCHEMBL5323213

NC(CCc1scc2ccccc12)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.42
GRIK1 P39086 2/20 0.41
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
ALPI P09923 1/20 0.40
PKM P14618 1/20 0.40
PTGS1 P23219 1/20 0.40
XIAP P98170 1/20 0.40
SLC7A5 Q01650 1/20 0.40
GRM2 Q14416 1/20 0.38
GRM3 Q14832 1/20 0.38
GRIK2 Q13002 1/20 0.38
LTA4H P09960 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL5320285 0.85 SLC7A5 (0.50) KIF11GRIK1SLC1A3SLC1A2SLC1A1
SCHEMBL9351582 0.85 SLC7A5 (0.50) KIF11GRIK1SLC1A3SLC1A2SLC1A1
SCHEMBL9195483 0.74 CYP1A2 (0.51) KMT2ATDP1
SCHEMBL5324039 0.74 SLC1A3 (0.54) KIF11GRIK1SLC1A3SLC1A2SLC1A1
SCHEMBL5327764 0.73 CYP2A6 (0.51) KIF11POLB
SCHEMBL29568019 0.73 CYP2A6 (0.51) KIF11POLB
SCHEMBL7429598 0.73 TDP1 (0.50) POLBKMT2ATDP1
SCHEMBL1395762 0.71 MAPT (0.38) POLBKMT2ATDP1
Homophenylalanine SCHEMBL44311 0.70 ALPI (0.64) KIF11GRIK1SLC1A3SLC1A2SLC1A1
Homophenylalanine SCHEMBL1078733 0.70 ALPI (0.64) KIF11GRIK1SLC1A3SLC1A2SLC1A1

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
US-20070258899-A1 Diagnostic and therapeutic agents KARYON-CTT LTD (FI) 2007-11-08 US disclosed
WO-2007113385-A1 DIAGNOSTIC AND THERAPEUTIC AGENTS KARYON-CTT LTD (FI) 2007-10-11 WO 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-20070258899-A1 Diagnostic and therapeutic agents YBX1, MLX, TPX2 KIF11 1678/4885GRIK1 4162/4885SLC1A3 4472/4885

“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.