SCHEMBL18136104

SCHEMBL18136104

CC(=O)c1cc(Cl)c(Cl)[nH]1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.38
KCNA6 P17658 1/20 0.35
KCNA3 P22001 1/20 0.35
KCNA4 P22459 1/20 0.35
KCNA5 P22460 1/20 0.35
CCNC P24863 1/20 0.33
CDK8 P49336 1/20 0.33
GRIN1 Q05586 1/20 0.32
TTR P02766 1/20 0.32
EIF4A3 P38919 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
SCHEMBL2940426 0.79 BLM (0.50) DAOGRIN1TTREIF4A3
SCHEMBL11607578 0.79 DAO (0.39) DAOKCNA6KCNA3KCNA4KCNA5
SCHEMBL8278471 0.77 TYMP (0.36) DAOKCNA6KCNA3KCNA4KCNA5
Hydrochloric Acid SCHEMBL11607586 0.77 GRIN1 (0.48) DAOGRIN1TTREIF4A3
SCHEMBL24112866 0.77 ALOX15 (0.51) DAOKCNA6KCNA3KCNA4KCNA5
SCHEMBL3022139 0.77 TTR (0.38) DAOCCNCCDK8GRIN1TTR
SCHEMBL11813309 0.74 DAO (0.36) DAOKCNA6KCNA3KCNA4KCNA5
SCHEMBL3035325 0.72 CYP1A2 (0.40)
SCHEMBL24740419 0.72 ALOX15 (0.55) DAOKCNA6KCNA3KCNA4KCNA5
SCHEMBL24019830 0.72 ALOX15 (0.55) DAOKCNA6KCNA3KCNA4KCNA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160297830-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF BACTERIAL INFECTIOUS DISEASES GALAPAGOS NV (BE) 2016-10-13 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-20160297830-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF BACTERIAL INFECTIOUS DISEASES POLR2E, POLB, POLI DAO 1152/4885KCNA6 4369/4885KCNA3 4116/4885

“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.