SCHEMBL6709727

SCHEMBL6709727

O=C1CNC(=O)N1Sc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.44
GSK3B P49841 1/20 0.44
MAPT P10636 3/20 0.42
HSD17B10 Q99714 2/20 0.42
ALDH1A1 P00352 1/20 0.42
BRPF1 P55201 1/20 0.37
MEN1 O00255 5/20 0.33
KMT2A Q03164 5/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
TSHR P16473 1/20 0.32
ABL1 P00519 1/20 0.32
LMNA P02545 1/20 0.32
RIN1 Q13671 1/20 0.32
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL812586 0.75 MAPT (0.52) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL8379436 0.74 MEN1 (0.42) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL1165632 0.72 MAPT (0.44) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL20503175 0.71 ALDH1A1 (0.43) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL8661738 0.69 GSK3A (0.57) GSK3AGSK3BALDH1A1MEN1KMT2A
SCHEMBL1163597 0.69 MGLL (0.50) GSK3AGSK3BMAPTHSD17B10ALDH1A1
SCHEMBL6829977 0.68 MAPT (0.49) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL1041075 0.68 MAPT (0.41) MAPTHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL809458 0.67 CASP3 (0.48) MAPTHSD17B10ALDH1A1NPC1RAB9A
SCHEMBL30872008 0.67 CASP3 (0.48) MAPTHSD17B10ALDH1A1NPC1RAB9A

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-20040029181-A1 Novel metal complex and method for determining amino acid sequence of protein using the same SHIMADZU CORPORATION (JP) 2004-02-12 US disclosed
US-4088751-A SHAVING CREAM, SHAMPOO, LOTION, 2-THIO-4-OXYPYRIMIDINE OR THIOHYDANTOIN AND HYDROGEN PEROXIDE, EXOTHERMIC REDOX REACTION COLGATE-PALMOLIVE COMPANY (US) 1978-05-09 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-20040029181-A1 Novel metal complex and method for determining amino acid sequence of protein using the same CACYBP, CAB39, APBA1 GSK3A 4843/4885GSK3B 4871/4885MAPT 3805/4885

“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.