SCHEMBL19914428

SCHEMBL19914428

Nc1ccc(N2CCCCC2)cc1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.65
▸ ALOX15 P16050 4/20 0.65
▸ HTT P42858 4/20 0.65
▸ ALDH1A1 P00352 4/20 0.65
▸ GAA P10253 3/20 0.65
▸ L3MBTL1 Q9Y468 3/20 0.65
▸ MAPK1 P28482 3/20 0.65
▸ S100B P04271 2/20 0.65
▸ MEN1 O00255 2/20 0.65
▸ KMT2A Q03164 2/20 0.65
▸ LMNA P02545 2/20 0.65
▸ TDP1 Q9NUW8 2/20 0.65
▸ PKM P14618 1/20 0.65
▸ IP6K1 Q92551 2/20 0.57
▸ HSD17B10 Q99714 2/20 0.52
▸ KDM4E B2RXH2 2/20 0.52
▸ RECQL P46063 2/20 0.52
▸ POLB P06746 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ USP2 O75604 1/20 0.52

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
SCHEMBL31208319 0.98 GAA (0.61) MAPTALOX15HTTALDH1A1GAA
SCHEMBL2550018 0.98 GAA (0.61) MAPTALOX15HTTALDH1A1GAA
SCHEMBL19381718 0.85 S100B (0.65) MAPTALOX15HTTALDH1A1GAA
SCHEMBL10290706 0.84 L3MBTL1 (0.60) MAPTALOX15HTTALDH1A1GAA
SCHEMBL10804218 0.82 ALDH1A1 (0.50) MAPTALOX15HTTALDH1A1GAA
SCHEMBL2759980 0.82 MAPT (0.71) MAPTALOX15HTTALDH1A1GAA
SCHEMBL8074303 0.82 MAPT (0.71) MAPTALOX15HTTALDH1A1GAA
SCHEMBL31473820 0.81 LGMN (0.67) MAPTALOX15HTTALDH1A1MAPK1
SCHEMBL4988458 0.81 LGMN (0.67) MAPTALOX15HTTALDH1A1MAPK1
SCHEMBL3531372 0.81 GAA (0.67) MAPTHTTALDH1A1GAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190194179-A1 ANTIBIOTIC COMPOUNDS DISCUVA LTD. (GB) 2019-06-27 — — US disclosed
US-20190194179-A1 ANTIBIOTIC COMPOUNDS DISCUVA LTD. (GB) 2019-06-27 — — US disclosed
WO-2018037223-A1 ANTIBIOTIC COMPOUNDS DISCUVA LTD. (GB) 2018-03-01 — — WO 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-20190194179-A1 ANTIBIOTIC COMPOUNDS B3GNT2, RPN2, RPN1 MAPT 1807/4885ALOX15 3203/4885HTT 3352/4885

“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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