SCHEMBL5468613

SCHEMBL5468613

O=C1C=Cc2scnc2C1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40

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
SCHEMBL8943930 0.72
SCHEMBL5726977 0.67 GSK3A (0.40) GSK3AGSK3B
SCHEMBL29750384 0.65 GSK3A (0.39) GSK3AGSK3B
Hydrochloric Acid SCHEMBL28537243 0.64 GSK3A (0.37) GSK3AGSK3B
SCHEMBL11349207 0.64 GSK3A (0.37) GSK3AGSK3B
Hydrochloric Acid SCHEMBL6025174 0.64 GSK3A (0.37) GSK3AGSK3B
SCHEMBL2009985 0.64
SCHEMBL208590 0.62
SCHEMBL277815 0.61
SCHEMBL207029 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3094626-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS AS RXR AGONISTS Connexios Life Sciences Pvt. Ltd. (IN) 2016-11-23 EP disclosed
WO-2015107549-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS AS RXR AGONISTS CONNEXIOS LIFE SCIENCES PVT. LTD. (IN) 2015-07-23 WO disclosed
US-20070054899-A1 Aromatase inhibitor compounds and uses thereof PARALLEL WIRELESS, INC. 2007-03-08 US disclosed
CN-1886403-A Use of a compound of formula (i) as an inhibitor of aromatase for therapeutic purposes and compounds of formula (1) thereas YANG JI CHEMICAL COMPANY LTD (KR) 2006-12-27 CN disclosed
EP-1678170-A1 USE OF A COMPOUND OF FORMULA (I) AS AN INHIBITOR OF AROMATASE FOR THERAPEUTIC PURPOSES AND COMPOUNDS OF FORMULA (1) THEREAS Yang Ji Chemical Company Ltd. (KR) 2006-07-12 EP disclosed
WO-2005033104-A1 USE OF A COMPOUND OF FORMULA (I) AS AN INHIBITOR OF AROMATASE FOR THERAPEUTIC PURPOSES AND COMPOUNDS OF FORMULA (1) THEREAS YANG JI CHEMICAL COMPANY, LTD (KR) 2005-04-14 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-20070054899-A1 Aromatase inhibitor compounds and uses thereof CYP19A1, CYP17A1, HSD17B11 GSK3A 173/4885GSK3B 162/4885

“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.