SCHEMBL880178

SCHEMBL880178

CCc1c(C(=O)NNC(=O)C(O)c2cc(F)cc(F)c2)ccc(OCc2ccccc2)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.38
LRRK2 Q5S007 3/20 0.38
BRD4 O60885 2/20 0.38
CTSK P43235 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
SMPD1 P17405 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL6519468 1.00 MAPT (0.43) MAPTL3MBTL1SMN1; SMN2NPC1CYP2C9
SCHEMBL6518890 1.00 MAPT (0.43) MAPTL3MBTL1SMN1; SMN2NPC1CYP2C9
SCHEMBL6518886 1.00 MAPT (0.43) MAPTL3MBTL1SMN1; SMN2NPC1CYP2C9
SCHEMBL880174 0.87 EIF2S1 (0.37) KMT2A
SCHEMBL880173 0.87 EIF2S1 (0.37) KMT2A
SCHEMBL6520061 0.86 EIF2S1 (0.39) SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL880181 0.83 MAPT (0.44) MAPTL3MBTL1SMN1; SMN2NPC1CYP2C9
SCHEMBL880168 0.81 EIF2AK3 (0.37)
SCHEMBL880175 0.81 EIF2AK3 (0.37)
SCHEMBL6518734 0.81 EIF2AK3 (0.37)

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 MAPT 2569/4885L3MBTL1 2152/4885SMN1; SMN2 2634/4885

“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.