SCHEMBL12880355

SCHEMBL12880355

CCCCCc1c(-c2cc(F)c(F)c(F)c2)cc(-c2cc(F)c(F)c(F)c2)c(OC)c1-c1c(CCCCC)c(-c2cc(F)c(F)c(F)c2)cc(-c2cc(F)c(F)c(F)c2)c1OC

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.43
GCGR P47871 5/20 0.35
FFAR4 Q5NUL3 2/20 0.34
FFAR1 O14842 1/20 0.34
RARB P10826 3/20 0.32
RARA P10276 1/20 0.32
RARG P13631 1/20 0.32
PTGS2 P35354 1/20 0.31
CD274 Q9NZQ7 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
SCHEMBL548615 0.77 FFAR1 (0.36) FFAR4FFAR1PTGS2CD274
SCHEMBL12880837 0.75 MAPT (0.40) GCGR
SCHEMBL12865413 0.75 FFAR1 (0.33) FFAR4FFAR1
SCHEMBL17356573 0.74 GCGR (0.36) ALOX5GCGRRARBRARARARG
SCHEMBL17356581 0.69 GCGR (0.36) ALOX5GCGRRARBRARARARG
SCHEMBL21663934 0.67 ALOX5 (0.43) ALOX5RARBRARARARGPTGS2
SCHEMBL16258044 0.67 RARB (0.53) RARBRARARARGPTGS2
SCHEMBL17356649 0.66 TYR (0.41) ALOX5GCGRRARBRARARARG
SCHEMBL17356622 0.66 RARB (0.56) RARBRARARARGPTGS2
SCHEMBL17356659 0.66 RARB (0.49) RARBRARARARGPTGS2

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-20110034688-A1 OPTICALLY ACTIVE DIBENZAZEPINE DERIVATIVES NIPPON SODA CO., LTD. (JP) 2011-02-10 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-20110034688-A1 OPTICALLY ACTIVE DIBENZAZEPINE DERIVATIVES DRD1, DRD4, DRD2 ALOX5 2232/4885GCGR 2645/4885FFAR4 2081/4885

“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.