SCHEMBL10079285

SCHEMBL10079285

CC(C)[C@H]1CCC[C@H]2CC[C@@H](C)N2C1=O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.36
OPRM1 P35372 2/20 0.35
OPRL1 P41146 2/20 0.35
OPRK1 P41145 1/20 0.35
PIK3CD O00329 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MCOLN3 Q8TDD5 1/20 0.31
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
XIAP P98170 1/20 0.30

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
SCHEMBL10060261 0.84 MAPK1 (0.37) MAPK1OPRM1OPRL1OPRK1ALDH1A1
SCHEMBL11952915 0.83 MAPK1 (0.36) MAPK1OPRM1OPRL1OPRK1PIK3CD
SCHEMBL15468305 0.78 CA1 (0.39) MAPK1PIK3CDALDH1A1LMNATP53
SCHEMBL10060271 0.77 OPRM1 (0.34) OPRM1OPRL1OPRK1PIK3CD
SCHEMBL15468302 0.74 MAPK1 (0.36) MAPK1PIK3CDALDH1A1LMNATP53
SCHEMBL10060268 0.72 MAPK1 (0.36) MAPK1ALDH1A1MCOLN3
SCHEMBL10079286 0.72 FAP (0.31)
SCHEMBL418973 0.71 PIK3CD (0.34) PIK3CDALDH1A1
SCHEMBL14585063 0.71 PIK3CD (0.34) PIK3CDALDH1A1
SCHEMBL7713426 0.71 XIAP (0.36) MAPK1XIAP

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-8163792-B2 IAP BIR domain binding compounds PHARMASCIENCE INC. (CA) 2012-04-24 US disclosed
US-20090192140-A1 IAP BIR DOMAIN BINDING COMPOUNDS AEGERA THERAPEUTICS INC. (CA) 2009-07-30 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-20090192140-A1 IAP BIR DOMAIN BINDING COMPOUNDS BIRC5, BIRC2, BIRC3 MAPK1 890/4885OPRM1 4489/4885OPRL1 3302/4885

“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.