SCHEMBL17017044

SCHEMBL17017044

CCOc1ccc(-c2ccc(OCc3ccc(C4CCC(/C=C(\F)CF)CC4)cc3)cc2)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 6/20 0.40
▸ MRGPRX4 Q96LA9 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33
▸ ESR1 P03372 1/20 0.32
▸ KCNH2 Q12809 1/20 0.31
▸ CSF1R P07333 1/20 0.31
▸ NPC1 O15118 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ FFAR1 O14842 3/20 0.31
▸ APP P05067 2/20 0.31
▸ PPARD Q03181 2/20 0.31
▸ PPARG P37231 1/20 0.30
▸ PPARA Q07869 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ HTT P42858 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
SCHEMBL17016754 0.92 FPR2 (0.34) FFAR4ESR1FPR2
SCHEMBL17017024 0.91 FFAR4 (0.36) FFAR4FPR2
SCHEMBL22277487 0.86 FFAR4 (0.40) FFAR4MRGPRX4HRH3ESR1KCNH2
SCHEMBL17017066 0.85 MAPT (0.33) FFAR4ALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL17016755 0.84 FPR2 (0.34) FFAR4APPFPR2
SCHEMBL17016751 0.84 FPR2 (0.34) FFAR4APPFPR2
SCHEMBL16071781 0.83 FFAR4 (0.43) FFAR4MRGPRX4HRH3ESR1KCNH2
SCHEMBL17016750 0.81 FPR2 (0.35) FFAR4ESR1ALDH1A1KDM4EAPP
SCHEMBL17016749 0.81 FPR2 (0.35) FFAR4ESR1ALDH1A1KDM4EAPP
SCHEMBL17016746 0.81 FPR2 (0.35) FFAR4ESR1APPFPR2

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 FFAR4 828/4885MRGPRX4 4426/4885HRH3 757/4885

“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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