SCHEMBL16624673

SCHEMBL16624673

CC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACE P12821 14/20 0.56
LMNA P02545 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.48
ABCB11 O95342 1/20 0.48
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
KMT2A Q03164 1/20 0.47
CYP3A4 P08684 1/20 0.47
ALOX15 P16050 1/20 0.47

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
SCHEMBL20227445 0.91 ACE (0.67) ACELMNA
SCHEMBL19645413 0.87 ACE (0.69) ACELMNASMN1; SMN2ABCB11MEN1
SCHEMBL8324111 0.85 ACE (0.58) ACELMNAABCB11MEN1KMT2A
SCHEMBL31721186 0.82 ACE (0.63) ACELMNASMN1; SMN2ABCB11MEN1
SCHEMBL8320933 0.81 MME (0.51) ACESMN1; SMN2MEN1KMT2A
SCHEMBL14001338 0.81 ACE (0.76) ACELMNASMN1; SMN2
SCHEMBL13930194 0.79 ACE (0.52) ACELMNASMN1; SMN2ABCB11MEN1
SCHEMBL20224665 0.79 ACE (0.45) ACELMNASMN1; SMN2ABCB11MEN1
SCHEMBL14523349 0.78 ACE (0.66) ACELMNA
SCHEMBL8319633 0.78 ACE (0.68) ACELMNAABCB11

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-20150098993-A1 COMPOSITIONS, PROCESS OF PREPARATION OF SAID COMPOSITIONS AND METHOD OF TREATING INFLAMMATORY DISEASES CELLWORKS GROUP, INC. 2015-04-09 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-20150098993-A1 COMPOSITIONS, PROCESS OF PREPARATION OF SAID COMPOSITIONS AND METHOD OF TREATING INFLAMMATORY DISEASES TNF, C5, IL5 ACE 798/4885LMNA 869/4885SMN1; SMN2 3685/4885

“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.