SCHEMBL17016799

SCHEMBL17016799

CCOc1ccc(-c2ccc(/C=C(\F)CF)c(F)c2F)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 1/20 0.33
▸ HPGD P15428 2/20 0.32
▸ TSHR P16473 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ FGFR2 P21802 2/20 0.31
▸ FGFR1 P11362 1/20 0.31
▸ CTSL P07711 1/20 0.30
▸ CTSS P25774 1/20 0.30
▸ CTSK P43235 1/20 0.30
▸ MRGPRX1 Q96LB2 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
SCHEMBL17016802 0.90 HPGD (0.33) HPGDTSHRMEN1LMNAMAPT
SCHEMBL17016797 0.85 HPGD (0.33) HPGDTSHRLMNAMAPTSMN1; SMN2
SCHEMBL17016780 0.81 KMT2A (0.34) MEN1LMNAMAPTKMT2ANPSR1
SCHEMBL16855852 0.78 L3MBTL1 (0.42) HPGDMEN1MAPTRAB9AKMT2A
SCHEMBL10010397 0.77 LMNA (0.44) HPGDLMNAMAPTSMN1; SMN2NPSR1
SCHEMBL17016798 0.77 HPGD (0.33) HPGDTSHRLMNAMAPTNPSR1
SCHEMBL17016809 0.76 CTSS (0.40) CTSLCTSSCTSK
SCHEMBL17021070 0.76 CTSS (0.40) CTSLCTSSCTSK
SCHEMBL12023440 0.75 HPGD (0.33) HPGDTSHRMEN1LMNAMAPT
SCHEMBL17016812 0.74 CTSS (0.39) CTSLCTSSCTSK

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-9404040-B2 Liquid crystal compound having fluorine-containing alkenyl terminal group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-08-02 — — US disclosed
US-9404040-B2 Liquid crystal compound having fluorine-containing alkenyl terminal group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-08-02 — — US disclosed
US-20150232759-A1 Liquid crystal compound having fluorine-containing alkenyl terminal group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-08-20 — — US disclosed
US-20150232759-A1 Liquid crystal compound having fluorine-containing alkenyl terminal group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-08-20 — — 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-20150232759-A1 Liquid crystal compound having fluorine-containing alkenyl terminal group, liquid crystal composition and liquid crystal display device PYM1, CXCR1, LEO1 TLR8 4356/4885HPGD 4702/4885TSHR 3570/4885

“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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