SCHEMBL17355679

SCHEMBL17355679

CCCCS(=O)(=O)Oc1ccc(F)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALPL P05186 6/20 0.49
ALPI P09923 6/20 0.49
CA12 O43570 3/20 0.36
CA2 P00918 3/20 0.36
MMP2 P08253 1/20 0.35
MMP7 P09237 1/20 0.35
MMP9 P14780 1/20 0.35
MMP14 P50281 1/20 0.35
JAK1 P23458 1/20 0.35
PDIA6 Q15084 1/20 0.35
HTR2A P28223 1/20 0.35
SLC6A4 P31645 1/20 0.35
KCNH2 Q12809 1/20 0.35
CNR1 P21554 1/20 0.34
CA1 P00915 1/20 0.34
TSHR P16473 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL17355674 0.91 CA12 (0.44) ALPLALPICA12CA2MMP2
SCHEMBL17355683 0.85 ALPI (0.43) ALPLALPICA12CA2MMP2
SCHEMBL17356303 0.81 ALPL (0.44) ALPLALPICA12CA2HTR2A
SCHEMBL26093334 0.78 ALPL (0.48) ALPLALPICA12CA2TSHR
SCHEMBL27656352 0.77 CA2 (0.50) ALPLALPICA12CA2MMP2
SCHEMBL17355691 0.77 HTR2A (0.35) ALPIPDIA6HTR2ASLC6A4KCNH2
SCHEMBL17355678 0.76 EPAS1 (0.35) PDIA6HTR2ASLC6A4KCNH2TSHR
SCHEMBL29028761 0.76 ALPL (0.42) ALPLALPICA12CA2MMP2
SCHEMBL14474330 0.75 MCL1 (0.46) CA12CA2PDIA6CA1TSHR
SCHEMBL17355677 0.75 PTGS2 (0.39) CA2HTR2ASLC6A4KCNH2CA1

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-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 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-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE HCN2, SCO2, HCN1 ALPL 791/4885ALPI 1701/4885CA12 2756/4885

“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.