SCHEMBL12730872

SCHEMBL12730872

FC(F)(F)Oc1ccc(C2CCC(OCC3CCC4OC4C3)CC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 3/20 0.36
▸ HCRTR2 O43614 4/20 0.35
▸ CARM1 Q86X55 1/20 0.35
▸ PRMT6 Q96LA8 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ EPHX2 P34913 1/20 0.34
▸ TRPA1 O75762 1/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ F2R P25116 1/20 0.33
▸ TMEM97 Q5BJF2 1/20 0.33
▸ KDM1A O60341 1/20 0.33
▸ RCOR1 Q9UKL0 1/20 0.33
▸ GRM2 Q14416 1/20 0.32
▸ FAAH O00519 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ TEAD1 P28347 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
SCHEMBL12730736 0.89 HRH3 (0.32) HCRTR2CARM1PRMT6HRH3EPHX2
SCHEMBL12730884 0.82 HSD11B1 (0.38) EPHX2CNR1FAAH
SCHEMBL12786930 0.81 LIPE (0.33) HRH3CNR1F2RTMEM97KDM1A
SCHEMBL12730869 0.79 RAB9A (0.42) GPR119HRH3
SCHEMBL14062600 0.78 HCRTR2 (0.38) HCRTR2CARM1PRMT6MEN1KMT2A
SCHEMBL12730879 0.75 HRH3 (0.41) HRH3EPHX2CNR1F2RTMEM97
SCHEMBL14062582 0.74 EPHX2 (0.35) HCRTR2CARM1PRMT6HRH3MEN1
SCHEMBL8457902 0.73 GPR119 (0.34) GPR119HCRTR2CARM1PRMT6MEN1
SCHEMBL8457897 0.73 GPR119 (0.34) GPR119HCRTR2CARM1PRMT6MEN1
SCHEMBL8457893 0.73 GPR119 (0.34) GPR119HCRTR2CARM1PRMT6MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404316-B2 Polymerizable liquid crystal compound and its polymer JNC CORPORATION (JP) 2013-03-26 — — US disclosed
US-8404316-B2 Polymerizable liquid crystal compound and its polymer JNC CORPORATION (JP) 2013-03-26 — — US disclosed
US-20110086185-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND AND ITS POLYMER CHISSO CORPORATION (JP) 2011-04-14 — — US disclosed
US-20110086185-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND AND ITS POLYMER CHISSO CORPORATION (JP) 2011-04-14 — — 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-20110086185-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND AND ITS POLYMER CCNT1, POF1B, CCND3 GPR119 4374/4885HCRTR2 1289/4885CARM1 386/4885

“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.

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