SCHEMBL2952186

SCHEMBL2952186

CCOC(=O)c1c(C(=O)OCC)c(-c2ccc3c(c2)OCO3)c2c3c(ccc2c1O)OCO3

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.52
PRKCZ Q05513 1/20 0.52
HSD17B10 Q99714 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
KDM4E B2RXH2 3/20 0.47
TP53 P04637 3/20 0.47
MAPT P10636 6/20 0.47
HPGD P15428 4/20 0.47
LMNA P02545 2/20 0.47
ALDH1A1 P00352 4/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
MAPK1 P28482 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RAB9A P51151 6/20 0.45
TSHR P16473 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
JAK2 O60674 1/20 0.45
JAK3 P52333 1/20 0.45
CYP19A1 P11511 1/20 0.44

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
SCHEMBL2954233 0.89 PRKCI (0.49) PRKCIPRKCZHSD17B10SMN1; SMN2KDM4E
SCHEMBL22117121 0.88 PRKCI (0.56) PRKCIPRKCZHSD17B10SMN1; SMN2KDM4E
SCHEMBL10018127 0.85 PRKCI (0.53) PRKCIPRKCZHSD17B10SMN1; SMN2KDM4E
SCHEMBL10049626 0.82 MAPT (0.58) PRKCIPRKCZHSD17B10SMN1; SMN2KDM4E
SCHEMBL8085173 0.81 ALDH1A1 (0.46) KDM4ETP53HPGDALDH1A1MAPK1
SCHEMBL9860617 0.78 SLC10A2 (0.48) SMN1; SMN2KDM4ETP53MAPTHPGD
SCHEMBL8081905 0.77 ALOX5 (0.45) KDM4EHPGDALDH1A1MAPK1
SCHEMBL8072416 0.74 ALDH1A1 (0.42) KDM4EHPGDALDH1A1MAPK1
SCHEMBL9860611 0.74 PRKCI (0.42) PRKCIPRKCZHSD17B10SMN1; SMN2KDM4E
SCHEMBL8084976 0.74 EDNRB (0.50) HSD17B10SMN1; SMN2KDM4ETP53MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080167353-A1 Novel Antiviral Helioxanthin Analogs YALE UNIVERSITY (US) 2008-07-10 US claimed
WO-2005107742-A1 NOVEL ANTIVIRAL HELIOXANTHIN ANALOGS YALE UNIVERSITY (US) 2005-11-17 WO claimed
US-7754718-B2 Antiviral helioxanthin analogs YALE UNIVERSITY (US) 2010-07-13 US disclosed
US-20080167353-A1 Novel Antiviral Helioxanthin Analogs YALE UNIVERSITY (US) 2008-07-10 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-20080167353-A1 Novel Antiviral Helioxanthin Analogs HAVCR2, ZC3HAV1, DHX35 PRKCI 4078/4885PRKCZ 4412/4885HSD17B10 904/4885

“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.