SCHEMBL823096

SCHEMBL823096

CC(C)(C)OC(=O)N1C(=O)C=C(O)[C@H]1Cc1c[nH]c2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
MAPT P10636 3/20 0.43
HPGD P15428 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KLK7 P49862 2/20 0.41
RAB9A P51151 1/20 0.41
PKM P14618 2/20 0.41
LMNA P02545 1/20 0.41
PDE4D Q08499 2/20 0.41
TP53 P04637 1/20 0.40
GLA P06280 1/20 0.40
CYP3A4 P08684 1/20 0.40
THRB P10828 1/20 0.40
IDO1 P14902 1/20 0.40
RIPK1 Q13546 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HDAC2 Q92769 1/20 0.40

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
SCHEMBL818231 1.00 POLB (0.55) POLBMAPTHPGDKMT2AKDM4E
SCHEMBL22482842 0.81 POLB (0.52) POLBMAPTHPGDKMT2AKDM4E
SCHEMBL10386697 0.80 KLK7 (0.61) KLK7KLK5
SCHEMBL10387214 0.80 KLK7 (0.61) KLK7KLK5
SCHEMBL817748 0.77 POLB (0.55) POLBMAPTHPGDKMT2AKDM4E
SCHEMBL823090 0.77 POLB (0.55) POLBMAPTHPGDKMT2AKDM4E
SCHEMBL4626477 0.75 POLB (0.52) POLBMAPTHPGDKMT2AKDM4E
SCHEMBL1994060 0.74 TACR1 (0.53) POLBMAPTKMT2AKDM4EALDH1A1
SCHEMBL5634443 0.73 POLB (0.51) POLBMAPTHPGDKMT2AKDM4E
SCHEMBL16694863 0.73 POLB (0.48) POLBMAPTHPGDKMT2AKDM4E

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-20110288116-A1 IAP INHIBITORS TETRALOGIC PHARMACEUITCAL CORPORATION (US) 2011-11-24 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-20110288116-A1 IAP INHIBITORS XIAP, BIRC5, BIRC7 POLB 3282/4885MAPT 1439/4885HPGD 2979/4885

“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.