SCHEMBL13876015

SCHEMBL13876015

CCn1ccc(C(=O)C(C)(C)C)cc1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.37
ALOX5 P09917 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
PI4KA P42356 1/20 0.35
PIK3CG P48736 1/20 0.35
PI4KB Q9UBF8 1/20 0.35
HDAC6 Q9UBN7 2/20 0.35
MCHR1 Q99705 1/20 0.33
ACHE P22303 1/20 0.33
MAP3K5 Q99683 1/20 0.32
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32
TUBB4B P68371 1/20 0.32
TUBB3 Q13509 1/20 0.32
TUBB2A Q13885 1/20 0.32

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
SCHEMBL25552271 0.85 ALOX5 (0.35) ALOX5HDAC6
SCHEMBL25552371 0.83
SCHEMBL13876020 0.82 EPHX2 (0.40) ACACBPOLB
SCHEMBL4246332 0.81 POLB (0.47) ACACBPIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL12734354 0.81 ACACB (0.42) ACACBPIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL13876018 0.80 GRIA2 (0.42) ALOX5PIK3CDPIK3CAPI4KAPIK3CG
SCHEMBL13701778 0.80 LMNA (0.43) ACACBPOLB
SCHEMBL13876014 0.77 SLC18A3 (0.39) ALOX5PIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL13702358 0.77 PLK1 (0.43) ACACBPIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL13702294 0.75 PIK3CA (0.43) ACACBPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099184-A1 Substituted pyridineamide compounds useful as soluble epoxide hydrolase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-16 US disclosed
US-20090099184-A1 Substituted pyridineamide compounds useful as soluble epoxide hydrolase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-16 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-20090099184-A1 Substituted pyridineamide compounds useful as soluble epoxide hydrolase inhibitors EPHX1, EPHX2, NCEH1 ACACB 1386/4885ALOX5 94/4885PIK3CD 3968/4885

“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.