SCHEMBL14184992

SCHEMBL14184992

Cc1cccc2sc(NC(C)(C)C)nc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.56
▸ PKM P14618 1/20 0.54
▸ ALDH1A1 P00352 4/20 0.53
▸ GAA P10253 2/20 0.52
▸ MEN1 O00255 9/20 0.49
▸ KMT2A Q03164 9/20 0.49
▸ LMNA P02545 5/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ ALOX15 P16050 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ MCL1 Q07820 1/20 0.49
▸ ESR2 Q92731 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ ACHE P22303 1/20 0.46
▸ GRIN2B Q13224 1/20 0.46

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
SCHEMBL14184987 0.82 GAA (0.64) MAPTPKMALDH1A1GAAMEN1
SCHEMBL14532120 0.81 PKM (0.61) MAPTPKMALDH1A1GAAMEN1
SCHEMBL22855202 0.80 MEN1 (0.39) MAPTPKMALDH1A1GAAMEN1
SCHEMBL29470130 0.80 MEN1 (0.39) MAPTPKMALDH1A1GAAMEN1
Bromide SCHEMBL11827951 0.79 PKM (0.60) MAPTPKMALDH1A1GAAMEN1
SCHEMBL2138224 0.79 MEN1 (0.65) MAPTPKMALDH1A1GAAMEN1
Hydrochloric Acid SCHEMBL28945336 0.78 MEN1 (0.63) MAPTPKMALDH1A1GAAMEN1
SCHEMBL24928789 0.75 MAPT (0.58) MAPTPKMALDH1A1GAAMEN1
SCHEMBL21821838 0.75 MAPT (0.76) MAPTPKMALDH1A1GAAMEN1
SCHEMBL14127197 0.74 ALDH1A1 (0.63) MAPTPKMALDH1A1GAAMEN1

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-20080125399-A1 17 Beta-Acetamide-4-Azasteroids As Androgen Receptor Modulators MERCK SHARP & DOHME CORP. 2008-05-29 — — US disclosed
US-20080125399-A1 17 Beta-Acetamide-4-Azasteroids As Androgen Receptor Modulators MERCK SHARP & DOHME CORP. 2008-05-29 — — 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-20080125399-A1 17 Beta-Acetamide-4-Azasteroids As Androgen Receptor Modulators AR, CYP17A1, SHBG MAPT 3061/4885PKM 2259/4885ALDH1A1 967/4885

“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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