SCHEMBL2808434

SCHEMBL2808434

Nc1ccc(C(=O)O)cc1N.[NaH]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 1/20 0.59
LMNA P02545 1/20 0.55
KDM4E B2RXH2 11/20 0.52
GAA P10253 9/20 0.52
MAPT P10636 5/20 0.52
HSD17B10 Q99714 5/20 0.52
ALDH1A1 P00352 4/20 0.52
GFER P55789 4/20 0.52
THRB P10828 3/20 0.52
HPGD P15428 3/20 0.52
HTT P42858 1/20 0.52
PLEC Q15149 1/20 0.52
L3MBTL1 Q9Y468 3/20 0.50
POLB P06746 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
TSHR P16473 2/20 0.50
TP53 P04637 1/20 0.50
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48

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
SCHEMBL77186 0.98 CDC25B (0.61) CDC25BLMNAKDM4EGAAMAPT
SCHEMBL4824967 0.98 CDC25B (0.61) CDC25BLMNAKDM4EGAAMAPT
SCHEMBL29351778 0.98 CDC25B (0.61) CDC25BLMNAKDM4EGAAMAPT
SCHEMBL2892151 0.95 CDC25B (0.59) CDC25BLMNAKDM4EGAAMAPT
SCHEMBL2814914 0.95 CDC25B (0.59) CDC25BLMNAKDM4EGAAMAPT
Hydrochloric Acid SCHEMBL4653034 0.95 CDC25B (0.59) CDC25BLMNAKDM4EGAAMAPT
Water SCHEMBL2810848 0.95 CDC25B (0.59) CDC25BLMNAKDM4EGAAMAPT
SCHEMBL8648893 0.95 CDC25B (0.59) CDC25BLMNAKDM4EGAAMAPT
Hydrochloric Acid SCHEMBL828086 0.95 CDC25B (0.59) CDC25BLMNAKDM4EGAAMAPT
SCHEMBL8983903 0.89 CDC25B (0.53) CDC25BLMNAKDM4EGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100240908-A1 ACETYLENE COMPOUND FUJIFILM CORPORATION (JP) 2010-09-23 US disclosed
CN-101808982-A Acetylene compound FUJIFILM CORP 2010-08-18 CN disclosed
EP-2202221-A1 ACETYLENE COMPOUND Fujifilm Corporation (JP) 2010-06-30 EP 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-20100240908-A1 ACETYLENE COMPOUND NAT1, KATNA1, KAT2B CDC25B 3090/4885LMNA 1650/4885KDM4E 3178/4885

“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.