SCHEMBL8030808

SCHEMBL8030808

CC(c1ccc(F)cc1)N1CCCC(CO)C1=O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 11/20 0.46
CYP3A4 P08684 4/20 0.42
CYP2C9 P11712 3/20 0.42
CYP2C19 P33261 3/20 0.42
ACE P12821 2/20 0.40
PTGS2 P35354 1/20 0.38

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
SCHEMBL12860606 0.90 HSD11B1 (0.44) HSD11B1CYP3A4CYP2C9CYP2C19ACE
SCHEMBL14144468 0.87 HSD11B1 (0.43) HSD11B1CYP3A4CYP2C9CYP2C19ACE
SCHEMBL8038056 0.84 HSD11B1 (0.40) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL8038060 0.82 HSD11B1 (0.51) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL4298912 0.80 HSD11B1 (0.45) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL4100291 0.80 HSD11B1 (0.45) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL4304050 0.80 HSD11B1 (0.45) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL4294143 0.80 HSD11B1 (0.45) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL4296589 0.79 HSD11B1 (0.46) HSD11B1CYP3A4CYP2C9CYP2C19
SCHEMBL28775897 0.79 HSD11B1 (0.46) HSD11B1CYP3A4CYP2C9CYP2C19

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-20110027264-A1 GAMMA SECRETASE MODULATORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE SCHERING CORPORATION 2011-02-03 US disclosed
US-20110027264-A1 GAMMA SECRETASE MODULATORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE SCHERING CORPORATION 2011-02-03 US disclosed
WO-2009108766-A1 GAMMA SECRETASE MODULATORS FOR THE TREATMENT OF ALZHEIMER ' S DISEASE SCHERING CORPORATION (US) 2009-09-03 WO 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-20110027264-A1 GAMMA SECRETASE MODULATORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE BACE1, BACE2, PSEN1 HSD11B1 653/4885CYP3A4 3531/4885CYP2C9 4318/4885

“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.