SCHEMBL1788310

SCHEMBL1788310

COC(=O)c1ccc(-c2nn(NC(=O)CC3CC4CCC3C4)c(=O)c3ccccc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 5/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ MAPT P10636 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ MAPK1 P28482 2/20 0.43
▸ LMNA P02545 4/20 0.41
▸ RECQL P46063 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ HRH1 P35367 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL1788833 0.90 ALDH1A1 (0.47) HPGDALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL1788835 0.90 ALDH1A1 (0.47) HPGDALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL1789409 0.90 HPGD (0.48) HPGDALDH1A1SMN1; SMN2MAPTL3MBTL1
SCHEMBL1789407 0.90 HPGD (0.48) HPGDALDH1A1SMN1; SMN2MAPTL3MBTL1
SCHEMBL1785624 0.88 HPGD (0.43) HPGDALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL1791226 0.87 MAPT (0.45) HPGDALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL1791227 0.87 MAPT (0.45) HPGDALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL1786942 0.87 MAPT (0.45) HPGDALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL1787776 0.87 MAPT (0.46) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL1786888 0.87 ALDH1A1 (0.43) HPGDALDH1A1SMN1; SMN2MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629143-B2 Potassium channel modulators ABBVIE INC. (US) 2014-01-14 — — US claimed
US-20110124642-A1 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2011-05-26 — — US claimed
US-8629143-B2 Potassium channel modulators ABBVIE INC. (US) 2014-01-14 — — US disclosed
US-20110124642-A1 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2011-05-26 — — 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-20110124642-A1 POTASSIUM CHANNEL MODULATORS KCNQ1, KCNQ2, KCNQ3 HPGD 3401/4885ALDH1A1 1644/4885SMN1; SMN2 2070/4885

“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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