SCHEMBL6856599

SCHEMBL6856599

CCC(CC)OC(=O)c1cc(C(=O)OC(CC)CC)cc(S(=O)(=O)O)c1.[BaH2]

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 2/20 0.50
PRKCD Q05655 2/20 0.50
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
SERPINE1 P05121 1/20 0.38
LMNA P02545 1/20 0.36
CA12 O43570 3/20 0.35
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA7 P43166 3/20 0.35
CA9 Q16790 3/20 0.35
CA14 Q9ULX7 3/20 0.35
HSD17B10 Q99714 1/20 0.35
PTPN1 P18031 3/20 0.34
PTPN2 P17706 1/20 0.34
PTPN11 Q06124 1/20 0.34
KMT2A Q03164 1/20 0.32
ESR1 P03372 1/20 0.31

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
SCHEMBL6292961 0.97 PRKCA (0.50) PRKCAPRKCDLCKFYNSERPINE1
SCHEMBL6858610 0.91 PRKCA (0.63) PRKCAPRKCDLCKFYNSERPINE1
SCHEMBL6856904 0.89 PRKCA (0.44) PRKCAPRKCDLCKFYNSERPINE1
SCHEMBL6293179 0.88 PRKCA (0.63) PRKCAPRKCDLCKFYNSERPINE1
SCHEMBL6855990 0.87 PRKCA (0.60) PRKCAPRKCDLCKFYNESR1
SCHEMBL6296001 0.86 PRKCA (0.44) PRKCAPRKCDLCKFYNSERPINE1
SCHEMBL6291914 0.84 PRKCA (0.60) PRKCAPRKCDLCKFYNESR1
SCHEMBL6292960 0.83 PRKCA (0.49) PRKCAPRKCDSERPINE1LMNACA12
SCHEMBL6856593 0.83 PRKCA (0.49) PRKCAPRKCDSERPINE1LMNACA12
SCHEMBL6856344 0.81 CA12 (0.55) LCKFYNLMNACA12CA1

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-6830859-B2 Electrostatic latent images; containing barium salt of sulfoisophthalic acid RICOH COMPANY, LTD. (JP) 2004-12-14 US disclosed
US-20030077534-A1 Charge control agent and toner using same RICOH COMPANY, LTD. (JP) 2003-04-24 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-20030077534-A1 Charge control agent and toner using same BET1, SMARCA5, SMARCA1 PRKCA 4466/4885PRKCD 4692/4885LCK 3088/4885

“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.