SCHEMBL16501722

SCHEMBL16501722

CN(C)c1ccc(C(=O)Nc2ccc(-c3nc4cc(C#N)ccc4n3O)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.46
▸ ITK Q08881 9/20 0.45
▸ CTNNB1 P35222 1/20 0.45
▸ TCF7L2 Q9NQB0 1/20 0.45
▸ AURKA O14965 1/20 0.44
▸ MAP4K4 O95819 1/20 0.44
▸ CHEK2 O96017 1/20 0.44
▸ PRKCG P05129 1/20 0.44
▸ PHKG2 P15735 1/20 0.44
▸ MARK3 P27448 1/20 0.44
▸ FLT3 P36888 1/20 0.44
▸ CSNK1A1 P48729 1/20 0.44
▸ CSNK1D P48730 1/20 0.44
▸ CLK2 P49760 1/20 0.44
▸ GSK3B P49841 1/20 0.44
▸ IRAK1 P51617 1/20 0.44
▸ RPS6KA3 P51812 1/20 0.44

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
SCHEMBL16501718 0.92 MAPT (0.46) MAPTALDH1A1MAPK1RXFP1ITK
SCHEMBL16501723 0.87 MAPT (0.52) MAPTALDH1A1MAPK1RXFP1NPC1
SCHEMBL16501725 0.86 MAPT (0.53) MAPTALDH1A1MAPK1RXFP1NPC1
SCHEMBL16501724 0.83 MAPT (0.52) MAPTALDH1A1MAPK1RXFP1NPC1
SCHEMBL16501728 0.83 MAPT (0.59) MAPTALDH1A1MAPK1RXFP1NPC1
SCHEMBL13783488 0.83 MLYCD (0.50) ALDH1A1CTNNB1TCF7L2NPC1RAB9A
SCHEMBL13783487 0.81 NPC1 (0.45) MAPTRXFP1CTNNB1TCF7L2NPC1
SCHEMBL16509204 0.81 MAPT (0.50) MAPTALDH1A1MAPK1RXFP1NPC1
SCHEMBL16501717 0.80 MAPT (0.49) MAPTALDH1A1MAPK1RXFP1NPC1
SCHEMBL16501719 0.80 MAPT (0.49) MAPTALDH1A1MAPK1RXFP1NPC1

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-20110306611-A1 Transcription factor modulating compounds and methods of use thereof PARATEK PHARMACEUTICALS, INC. (US) 2011-12-15 — — US disclosed
US-20110306611-A1 Transcription factor modulating compounds and methods of use thereof PARATEK PHARMACEUTICALS, INC. (US) 2011-12-15 — — 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-20110306611-A1 Transcription factor modulating compounds and methods of use thereof JUN, CREBBP, TFEB MAPT 4415/4885ALDH1A1 3948/4885MAPK1 3243/4885

“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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