SCHEMBL6692744

SCHEMBL6692744

CC(C)[C@](O)(CCc1cccc(F)c1)CC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.41
SLC1A1 P43005 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
FFAR1 O14842 1/20 0.40
SLC13A5 Q86YT5 2/20 0.40
MAOB P27338 1/20 0.39
RIPK1 Q13546 1/20 0.39
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 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
SCHEMBL6298495 1.00 TAAR1 (0.41) TAAR1SLC1A1MEN1KMT2AFFAR1
SCHEMBL6692381 1.00 TAAR1 (0.41) TAAR1SLC1A1MEN1KMT2AFFAR1
SCHEMBL6303028 0.86 SLC13A5 (0.35) SLC13A5MAOBCYP2C19
SCHEMBL6692398 0.86 SLC13A5 (0.35) SLC13A5MAOBCYP2C19
SCHEMBL6303531 0.84 SLC13A5 (0.51) TAAR1MEN1KMT2AFFAR1SLC13A5
SCHEMBL6695081 0.84 SLC13A5 (0.49) MEN1KMT2AFFAR1SLC13A5CYP2D6
SCHEMBL6692391 0.84 SLC13A5 (0.49) MEN1KMT2AFFAR1SLC13A5CYP2D6
SCHEMBL6302904 0.84 SLC13A5 (0.49) MEN1KMT2AFFAR1SLC13A5CYP2D6
SCHEMBL6297597 0.83 SLC13A5 (0.44) MEN1KMT2AFFAR1SLC13A5CYP2D6
SCHEMBL6692548 0.83 SLC13A5 (0.44) MEN1KMT2AFFAR1SLC13A5CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040106606-A1 HIV protease inhibitors BOYER FREDERICK EARL (US) 2004-06-03 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-20040106606-A1 HIV protease inhibitors DNPEP, PREP, PEPD TAAR1 4863/4885SLC1A1 3914/4885MEN1 3684/4885

“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.