SCHEMBL12735985

SCHEMBL12735985

CCCCCc1ccc(-c2ccc(OCC3CCC(c4ccc(OC)c(F)c4F)CC3)c(F)c2F)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.36
FPR2 P25090 3/20 0.35
FFAR4 Q5NUL3 2/20 0.35
RARB P10826 1/20 0.34
SPHK1 Q9NYA1 5/20 0.34
ALOX5AP P20292 2/20 0.33
FEN1 P39748 2/20 0.33
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
CASP3 P42574 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32

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
SCHEMBL12740707 1.00 PDE4B (0.36) PDE4BFPR2FFAR4RARBSPHK1
SCHEMBL12740711 0.94 RARB (0.35) FFAR4RARBSPHK1ALOX5APFEN1
SCHEMBL12735998 0.94 RARB (0.35) FFAR4RARBSPHK1ALOX5APFEN1
SCHEMBL12735981 0.89 FPR2 (0.38) PDE4BFPR2ALOX5APFEN1
SCHEMBL12740706 0.89 FPR2 (0.38) PDE4BFPR2ALOX5APFEN1
SCHEMBL12740704 0.89 FFAR4 (0.34) FFAR4RARBSPHK1ALOX5APFEN1
SCHEMBL12735995 0.89 FFAR4 (0.34) FFAR4RARBSPHK1ALOX5APFEN1
SCHEMBL12740747 0.88 FFAR1 (0.39) FFAR4RARBPPARA
SCHEMBL12740780 0.88 HTR2A (0.38) FFAR4RARBPPARACASP3SENP8
SCHEMBL12736177 0.88 HTR2A (0.38) PDE4BFFAR4RARBCASP3SENP8

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed
US-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2011-04-21 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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 PDE4B 2984/4885FPR2 589/4885FFAR4 546/4885

“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.