SCHEMBL14562116

SCHEMBL14562116

Cc1onc(-c2ccccc2)c1-c1ccc(C(=O)NCCOCCO)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ PTGS2 P35354 6/20 0.42
▸ MT-CO2 P00403 2/20 0.42
▸ NR4A2 P43354 1/20 0.42
▸ GABRA5 P31644 3/20 0.42
▸ PTGS1 P23219 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40

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
SCHEMBL14562118 0.82 KDM4E (0.48) GAAKDM4EHTTMEN1KMT2A
SCHEMBL5423393 0.82 GABRA5 (0.50) KDM4EHTTMEN1KMT2AMAPT
SCHEMBL14562117 0.79 ALDH1A1 (0.62) HTTKMT2AL3MBTL1ALDH1A1HPGD
SCHEMBL5424070 0.78 PTGS2 (0.57) GAAKDM4EHTTMEN1KMT2A
SCHEMBL14562155 0.71 PTGS2 (0.48) GAAHTTMEN1KMT2AMAPT
SCHEMBL5655209 0.71 NPC1 (0.65) SMN1; SMN2HPGD
SCHEMBL14562122 0.70 GABRA5 (0.51) PTGS2MT-CO2NR4A2GABRA5PTGS1
SCHEMBL14562134 0.70 GABRA5 (0.63) GAAPTGS2MT-CO2NR4A2GABRA5
SCHEMBL14562102 0.69 PTGS2 (0.60) GAAHTTMEN1KMT2AMAPT
SCHEMBL5429944 0.69 PTGS2 (0.65) MAPTPTGS2MT-CO2NR4A2PTGS1

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-20070060629-A1 Large conductance calcium-activated k channel opener TANABE SEIYAKU CO., LTD. (JP) 2007-03-15 — — US disclosed
US-20070060629-A1 Large conductance calcium-activated k channel opener TANABE SEIYAKU CO., LTD. (JP) 2007-03-15 — — 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-20070060629-A1 Large conductance calcium-activated k channel opener KCNN3, KCNN1, KCNN2 GAA 4384/4885KDM4E 722/4885HTT 3097/4885

“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.

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