SCHEMBL880174

SCHEMBL880174

CCCCOc1ccc(C(=O)NNC(=O)[C@H](O)c2cc(F)cc(F)c2)c(CC)c1C

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EIF2S1 P05198 9/20 0.37
EIF2AK3 Q9NZJ5 9/20 0.37
FAAH O00519 2/20 0.37
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL880173 1.00 EIF2S1 (0.37) EIF2S1EIF2AK3FAAHPSEN1PSEN2
SCHEMBL6520061 0.88 EIF2S1 (0.39) EIF2S1EIF2AK3
SCHEMBL6518890 0.87 MAPT (0.43) KMT2A
SCHEMBL6518886 0.87 MAPT (0.43) KMT2A
SCHEMBL880178 0.87 MAPT (0.43) KMT2A
SCHEMBL880168 0.82 EIF2AK3 (0.37) EIF2S1EIF2AK3PSEN1PSEN2APH1B
SCHEMBL6518734 0.82 EIF2AK3 (0.37) EIF2S1EIF2AK3PSEN1PSEN2APH1B
SCHEMBL880175 0.82 EIF2AK3 (0.37) EIF2S1EIF2AK3PSEN1PSEN2APH1B
SCHEMBL12310656 0.75 CNR1 (0.40) MEN1KMT2A
SCHEMBL12310836 0.73 HDAC3 (0.39) PPARDPPARA

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-8546613-B2 SGK1 inhibitors for the prophylaxis and/or therapy of viral diseases and/or carcinomas MERCK PATENT GMBH (DE) 2013-10-01 US disclosed
EP-2242738-B1 SGK1 INHIBITORS FOR THE PROPHYLAXIS AND/OR THERAPY OF VIRAL DISEASES AND/OR CARCINOMAS MERCK PATENT GMBH (DE) 2012-03-28 EP disclosed
US-20110060050-A1 SGK1 INHIBITORS FOR THE PROPHYLAXIS AND/OR THERAPY OF VIRAL DISEASES AND/OR CARCINOMAS MERCK PATENT GMBH (DE) 2011-03-10 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-20110060050-A1 SGK1 INHIBITORS FOR THE PROPHYLAXIS AND/OR THERAPY OF VIRAL DISEASES AND/OR CARCINOMAS NCOA1, NR3C2, NCOA2 EIF2S1 927/4885EIF2AK3 453/4885FAAH 4584/4885

“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.