SCHEMBL31370144

SCHEMBL31370144

O=C(O)[C@@H]1CCC[C@H](c2ccccc2)N1C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.49
FABP7 O15540 2/20 0.49
FFAR2 O15552 4/20 0.43
KMT2A Q03164 2/20 0.39
MME P08473 1/20 0.39
ACE P12821 1/20 0.39
EPHX2 P34913 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL799703 0.93 FABP5 (0.51) FABP5FABP7FFAR2KMT2A
SCHEMBL3366299 0.93 FABP5 (0.51) FABP5FABP7FFAR2KMT2A
SCHEMBL31159434 0.93 FABP5 (0.51) FABP5FABP7FFAR2KMT2A
Fluoride SCHEMBL7821537 0.92 FABP5 (0.50) FABP5FABP7FFAR2KMT2A
SCHEMBL8124433 0.90 FABP5 (0.49) FABP5FABP7FFAR2KMT2AEPHX2
SCHEMBL31369486 0.85 ACE (0.47) FABP5FABP7FFAR2MMEACE
SCHEMBL13259973 0.84 FABP5 (0.46) FABP5FABP7FFAR2KMT2AEPHX2
SCHEMBL31369417 0.83 FFAR2 (0.44) FABP5FABP7FFAR2EPHX2
SCHEMBL31370160 0.81 FFAR2 (0.41) FABP5FABP7FFAR2
SCHEMBL31369524 0.81 FFAR2 (0.56) FABP5FABP7FFAR2

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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 US claimed
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES BCAT1, BCAT2, PELP1 FABP5 424/4885FABP7 508/4885FFAR2 3403/4885

“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.