SCHEMBL21175408

SCHEMBL21175408

CNC(C)C(=O)NC(C(=O)N1CCC[C@H]1C(=O)O)C1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BIRC2 Q13490 9/20 0.53
XIAP P98170 2/20 0.52
BIRC3 Q13489 2/20 0.52
ACE P12821 4/20 0.48
REN P00797 3/20 0.48
KDM4E B2RXH2 1/20 0.48
F2 P00734 1/20 0.48
LMNA P02545 1/20 0.48
LTA4H P09960 1/20 0.48
MAPT P10636 1/20 0.48
PEPD P12955 1/20 0.48
ALOX15 P16050 1/20 0.48
PTGS1 P23219 1/20 0.48
HTR2A P28223 1/20 0.48
PTGS2 P35354 1/20 0.48
HRH1 P35367 1/20 0.48
THPO P40225 1/20 0.48
PMP22 Q01453 1/20 0.48
HSD17B10 Q99714 1/20 0.48
ACE2 Q9BYF1 1/20 0.48

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
SCHEMBL15093340 1.00 BIRC2 (0.53) BIRC2XIAPBIRC3ACEREN
SCHEMBL15064278 1.00 BIRC2 (0.53) BIRC2XIAPBIRC3ACEREN
SCHEMBL15065055 1.00 BIRC2 (0.53) BIRC2XIAPBIRC3ACEREN
SCHEMBL3507780 1.00 BIRC2 (0.53) BIRC2XIAPBIRC3ACEREN
SCHEMBL28911875 1.00 BIRC2 (0.53) BIRC2XIAPBIRC3ACEREN
SCHEMBL15065057 1.00 BIRC2 (0.53) BIRC2XIAPBIRC3ACEREN
SCHEMBL15064445 0.99 BIRC2 (0.52) BIRC2XIAPBIRC3ACEREN
SCHEMBL15064444 0.99 BIRC2 (0.52) BIRC2XIAPBIRC3ACEREN
SCHEMBL28549430 0.99 BIRC2 (0.52) BIRC2XIAPBIRC3ACEREN
SCHEMBL15064522 0.95 ACE (0.50) BIRC2XIAPBIRC3ACEREN

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
CN-107915728-B IAP inhibitors 库里斯公司 2021-04-30 CN claimed
CN-107915728-B IAP inhibitors 库里斯公司 2021-04-30 CN disclosed
US-20190224269-A1 INHIBITORS OF IAP GENENTECH, INC. (US) 2019-07-25 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-20190224269-A1 INHIBITORS OF IAP BIRC5, XIAP, BIRC3 BIRC2 5/4885XIAP 2/4885BIRC3 3/4885

“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.