SCHEMBL7604990

SCHEMBL7604990

Cc1ccc(-c2cnc3cc(OS(=O)(=O)C(F)(F)F)ccc3c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 8/20 0.48
PDGFRA P16234 8/20 0.48
MAOB P27338 2/20 0.41
ESR2 Q92731 1/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
HSD11B1 P28845 1/20 0.38
GAK O14976 1/20 0.37

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
SCHEMBL7602494 0.92 PDGFRB (0.48) PDGFRBPDGFRAESR2CA1CA2
SCHEMBL15108960 0.88 PDGFRB (0.44) PDGFRBPDGFRAESR2CA1CA2
SCHEMBL15161581 0.82 PDGFRB (0.41) PDGFRBPDGFRAESR2CA1CA2
SCHEMBL26549500 0.81 CA12 (0.57) PDGFRBPDGFRACA1CA2CA12
SCHEMBL7601977 0.79 NPC1 (0.52) CA1CA2HSD11B1
SCHEMBL15851457 0.78 HSD11B1 (0.44) CA1CA2CA12CA9HSD11B1
SCHEMBL28294470 0.78 PDGFRB (0.47) PDGFRBPDGFRACA1CA2CA12
SCHEMBL28245204 0.78 CA1 (0.44) PDGFRBPDGFRAMAOBCA1CA2
SCHEMBL16811754 0.75 HSD11B1 (0.48) CA1CA2CA9HSD11B1
SCHEMBL31243801 0.75 HSD11B1 (0.48) CA1CA2CA9HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150057218-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS INC (US) 2015-02-26 US disclosed
US-8921369-B2 Inhibitors of HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2014-12-30 US disclosed
US-20130096101-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2013-04-18 US disclosed
US-20120122864-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2012-05-17 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 (3 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-20130096101-A1 INHIBITORS OF HCV NS5A HAVCR2, MAVS, EIF2AK2 PDGFRB 330/4885PDGFRA 657/4885MAOB 4087/4885
US-20120122864-A1 INHIBITORS OF HCV NS5A HAVCR2, MAVS, EIF2AK2 PDGFRB 338/4885PDGFRA 677/4885MAOB 4055/4885
US-20150057218-A1 INHIBITORS OF HCV NS5A HAVCR2, MAVS, EIF2AK2 PDGFRB 338/4885PDGFRA 677/4885MAOB 4055/4885

“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.