SCHEMBL10097091

SCHEMBL10097091

Cc1ccc(COC23CCC(C)(CC2)C(F)=C3F)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.34
NAAA Q02083 2/20 0.32
KDM5A P29375 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
KDM5B Q9UGL1 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
IDO1 P14902 2/20 0.31
AGXT P21549 2/20 0.31
MAPK14 Q16539 4/20 0.31
HPD P32754 1/20 0.30
FAAH O00519 1/20 0.30
MGLL Q99685 1/20 0.30

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
SCHEMBL10098319 0.86 ESR1 (0.36) NAAAFFAR4IDO1AGXTMAPK14
SCHEMBL10097094 0.80 AGXT (0.38) AGXTHPD
SCHEMBL10097088 0.79
SCHEMBL10098105 0.75
SCHEMBL3083666 0.68 IDO1 (0.42) RORCKDM5AKDM4CKDM5BIDO1
SCHEMBL12121014 0.68 IDO1 (0.42) KDM5AKDM4CKDM5BIDO1AGXT
SCHEMBL10097076 0.68 HTR2A (0.30)
Ammonia Solution, Strong SCHEMBL28443748 0.67 IDO1 (0.41) KDM5AKDM4CKDM5BIDO1AGXT
SCHEMBL1509989 0.65 IDO1 (0.40) RORCKDM5AKDM4CKDM5BIDO1
SCHEMBL16706452 0.65 HTR1A (0.43) NAAAIDO1AGXT

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-8124196-B2 Fluorobicyclo[2.2.2]octane compound, method of producing the same, and applications thereof FUJIFILM CORPORATION (JP) 2012-02-28 US disclosed
US-20100231844-A1 FLUOROBICYCLO[2.2.2]OCTANE COMPOUND, METHOD OF PRODUCING THE SAME, AND APPLICATIONS THEREOF FUJIFILM CORPORATION (JP) 2010-09-16 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-20100231844-A1 FLUOROBICYCLO[2.2.2]OCTANE COMPOUND, METHOD OF PRODUCING THE SAME, AND APPLICATIONS THEREOF AFF2, FPR2, SLCO1A2 RORC 1698/4885NAAA 4548/4885KDM5A 3909/4885

“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.