SCHEMBL17549447

SCHEMBL17549447

OCc1ccc(CNc2cccc3ccccc23)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.65
▸ ALDH1A1 P00352 5/20 0.65
▸ MAPT P10636 3/20 0.65
▸ MEN1 O00255 3/20 0.65
▸ KMT2A Q03164 3/20 0.65
▸ HPGD P15428 2/20 0.65
▸ SMN1; SMN2 Q16637 1/20 0.65
▸ TSHR P16473 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ GAA P10253 2/20 0.54
▸ CA12 O43570 2/20 0.50
▸ CA4 P22748 2/20 0.50
▸ CA7 P43166 2/20 0.50
▸ CA9 Q16790 2/20 0.50
▸ CA14 Q9ULX7 2/20 0.50
▸ GSK3B P49841 1/20 0.50
▸ CA3 P07451 1/20 0.50
▸ CA6 P23280 1/20 0.50
▸ CA5A P35218 1/20 0.50
▸ CA5B Q9Y2D0 1/20 0.50

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
SCHEMBL15459228 0.91 ALDH1A1 (0.75) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL1309320 0.86 KDM4E (0.65) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL30374630 0.85 KDM4E (0.68) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL3543756 0.85 KDM4E (0.68) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL12031409 0.83 ALDH1A1 (0.69) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL12309908 0.83 KDM4E (0.69) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL257902 0.82 ALDH1A1 (0.60) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL17131815 0.79 SMN1; SMN2 (0.60) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL16382891 0.79 CDC25B (0.65) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL1521372 0.79 ALDH1A1 (0.60) KDM4EALDH1A1MAPTMEN1KMT2A

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-20160058761-A1 Tricyclic Amino Containing Compounds for Treatment or Prevention of Symptoms Associated with Endocrine Dysfunction METASTATIX, INC. 2016-03-03 — — US disclosed
US-20160058761-A1 Tricyclic Amino Containing Compounds for Treatment or Prevention of Symptoms Associated with Endocrine Dysfunction METASTATIX, INC. 2016-03-03 — — 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-20160058761-A1 Tricyclic Amino Containing Compounds for Treatment or Prevention of Symptoms Associated with Endocrine Dysfunction SHBG, ABAT, GLS KDM4E 3609/4885ALDH1A1 3626/4885MAPT 3864/4885

“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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