SCHEMBL13025840

SCHEMBL13025840

CCCCCc1ccc(-c2ccc(OC(=O)c3ccc(CCC)cc3)c(F)c2C(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RARB P10826 10/20 0.49
MAPT P10636 2/20 0.43
RARA P10276 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MTOR P42345 1/20 0.43
KMT2A Q03164 1/20 0.43
MPL P40238 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
THRA P10827 3/20 0.39
THRB P10828 3/20 0.39
RARG P13631 1/20 0.39
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39

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
SCHEMBL3268316 0.87 RARB (0.53) RARBMAPTRARAMEN1ALDH1A1
SCHEMBL13025766 0.85 MAPT (0.51) RARBMAPTKMT2AMPLSMN1; SMN2
SCHEMBL13025825 0.84 MPL (0.39) RARBMAPTALDH1A1MPLSMN1; SMN2
SCHEMBL13025908 0.82 MAPT (0.39) RARBMAPTRARAMEN1ALDH1A1
SCHEMBL12737554 0.82 RARB (0.59) RARBMAPTRARAMEN1ALDH1A1
SCHEMBL12742645 0.82 RARB (0.47) RARBMAPTRARAMEN1ALDH1A1
SCHEMBL12742776 0.82 RARB (0.56) RARBMAPTRARAMEN1ALDH1A1
SCHEMBL12737471 0.82 RARB (0.47) RARBMAPTRARAMEN1ALDH1A1
SCHEMBL12742648 0.81 RARB (0.52) RARBMAPTRARAMEN1ALDH1A1
SCHEMBL12742654 0.81 RARB (0.52) RARBMAPTRARAMEN1ALDH1A1

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-7838087-B2 Benzene derivative, liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2010-11-23 US disclosed
US-20070200092-A1 Benzene Derivative, Liquid Crystal Composition And Liquid Crystal Display Device JNC PETROCHEMICAL CORPORATION (JP) 2007-08-30 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-20070200092-A1 Benzene Derivative, Liquid Crystal Composition And Liquid Crystal Display Device CCND2, YBX1, CNKSR1 RARB 228/4885MAPT 1989/4885RARA 222/4885

“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.