SCHEMBL19508664

SCHEMBL19508664

C=C1OCC(C)(C(=O)OCC)CO1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.53
BRD4 O60885 1/20 0.39
POLB P06746 1/20 0.37
OPRM1 P35372 6/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
MAPK1 P28482 2/20 0.34
MAPT P10636 3/20 0.33
KDM4E B2RXH2 1/20 0.33
ALOX15 P16050 1/20 0.33
LMNA P02545 2/20 0.33
ABCB11 O95342 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 4/20 0.32
GLA P06280 1/20 0.32
OPRD1 P41143 3/20 0.32
OPRK1 P41145 3/20 0.32
SLC22A1 O15245 1/20 0.32
SLC6A4 P31645 1/20 0.32
ADRA1A P35348 1/20 0.32

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
SCHEMBL663919 0.84 ATM (0.50) ATMBRD4POLBOPRM1MEN1
SCHEMBL21264371 0.80 ATM (0.35) ATMLMNA
SCHEMBL1538030 0.79 ATM (0.43) ATMBRD4POLBOPRM1MEN1
Water SCHEMBL1537978 0.77 ATM (0.42) ATMBRD4POLBOPRM1MEN1
SCHEMBL19088338 0.76 ATM (0.41) ATMBRD4POLBOPRM1MEN1
SCHEMBL5526295 0.76 BRD4 (0.45) ATMBRD4POLBOPRM1MEN1
SCHEMBL2289941 0.74
SCHEMBL17925879 0.73 BRD4 (0.48) ATMBRD4POLBOPRM1MEN1
SCHEMBL6890988 0.73 ATM (0.42) ATMBRD4POLBOPRM1MEN1
SCHEMBL6736700 0.72 POLB (0.46) ATMBRD4POLBOPRM1MEN1

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-10779539-B2 Antimicrobial guanidinium and thiouronium functionalized polymers CORAL BAY II, LLC. (US) 2020-09-22 US disclosed
US-20170303541-A1 ANTIMICROBIAL GUANIDINIUM AND THIOURONIUM FUNCTIONALIZED POLYMERS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2017-10-26 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 (2 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-20170303541-A1 ANTIMICROBIAL GUANIDINIUM AND THIOURONIUM FUNCTIONALIZED POLYMERS PUF60, CAPG, GMPS ATM 3036/4885BRD4 2439/4885POLB 1100/4885
US-10779539-B2 Antimicrobial guanidinium and thiouronium functionalized polymers PUF60, CAPG, GMPS ATM 3036/4885BRD4 2439/4885POLB 1100/4885

“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.