SCHEMBL18186604

SCHEMBL18186604

CCOc1ccc(F)c(C(=O)c2ccc(-c3cccc(NS(=O)(=O)c4ccc(Br)cc4OC(F)(F)F)c3)s2)c1F

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 19/20 0.80
HSD17B2 P37059 19/20 0.80
ALPL P05186 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
SCHEMBL18186459 0.91 HSD17B1 (0.79) HSD17B1HSD17B2
SCHEMBL18186448 0.89 HSD17B1 (1.00) HSD17B1HSD17B2
SCHEMBL18186443 0.85 HSD17B1 (0.75) HSD17B1HSD17B2
SCHEMBL18186572 0.81 HSD17B1 (1.00) HSD17B1HSD17B2
SCHEMBL18186433 0.81 HSD17B1 (0.82) HSD17B1HSD17B2
SCHEMBL18186605 0.80 HSD17B1 (0.52) HSD17B1HSD17B2
SCHEMBL31406 0.79 HSD17B1 (1.00) HSD17B1HSD17B2
SCHEMBL18186432 0.79 HSD17B1 (1.00) HSD17B1HSD17B2
SCHEMBL18186460 0.74 HSD17B1 (0.69) HSD17B1HSD17B2
SCHEMBL18186503 0.71 HSD17B1 (1.00) HSD17B1HSD17B2

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
US-9884839-B2 Inhibitors of 17Beta-hydroxysteroid dehydrogenases type 1 and type 2 ELEXOPHARM GMBH (DE) 2018-02-06 US disclosed
US-9884839-B2 Inhibitors of 17Beta-hydroxysteroid dehydrogenases type 1 and type 2 ELEXOPHARM GMBH (DE) 2018-02-06 US disclosed
US-9884839-B2 Inhibitors of 17Beta-hydroxysteroid dehydrogenases type 1 and type 2 ELEXOPHARM GMBH (DE) 2018-02-06 US disclosed
US-20160318895-A1 Inhibitors of 17Beta-Hydroxysteroid Dehydrogenases Type 1 and Type 2 ELEXOPHARM GMBH (DE) 2016-11-03 US disclosed
US-20160318895-A1 Inhibitors of 17Beta-Hydroxysteroid Dehydrogenases Type 1 and Type 2 ELEXOPHARM GMBH (DE) 2016-11-03 US disclosed
US-20160318895-A1 Inhibitors of 17Beta-Hydroxysteroid Dehydrogenases Type 1 and Type 2 ELEXOPHARM GMBH (DE) 2016-11-03 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-20160318895-A1 Inhibitors of 17Beta-Hydroxysteroid Dehydrogenases Type 1 and Type 2 HSD17B1, HSD17B2, HSD17B3 HSD17B1 1/4885HSD17B2 2/4885ALPL 1152/4885

“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.