SCHEMBL10302992

SCHEMBL10302992

CCCC(O)c1ccc(CCc2ccc(-c3ccc(OCC)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.35
▸ CTSL P07711 1/20 0.33
▸ CTSS P25774 1/20 0.33
▸ CTSK P43235 1/20 0.33
▸ GABRA1 P14867 4/20 0.32
▸ GABRB2 P47870 4/20 0.32
▸ S1PR1 P21453 2/20 0.32
▸ S1PR3 Q99500 2/20 0.32
▸ RET P07949 1/20 0.31
▸ CHKA P35790 1/20 0.31
▸ PPARG P37231 3/20 0.31
▸ PPARD Q03181 3/20 0.31
▸ PPARA Q07869 3/20 0.31
▸ FAAH O00519 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
SCHEMBL12717002 0.91 FFAR4 (0.35) FFAR4CTSLCTSSCTSKGABRA1
SCHEMBL13586170 0.91 FFAR4 (0.35) FFAR4CTSLCTSSCTSKGABRA1
SCHEMBL10303010 0.90 CNR2 (0.34) CTSLCTSSCTSKGABRA1GABRB2
SCHEMBL10303027 0.90 GABRA1 (0.33) CTSLCTSSCTSKGABRA1GABRB2
SCHEMBL10302850 0.88 FFAR4 (0.36) FFAR4CTSLCTSSCTSKGABRA1
SCHEMBL12718135 0.88 FFAR4 (0.35) FFAR4CTSLCTSSCTSKGABRA1
SCHEMBL10302991 0.87 ADRA2A (0.33) CHKA
SCHEMBL10302845 0.86 FFAR4 (0.35) FFAR4S1PR1S1PR3PPARGFAAH
SCHEMBL10303033 0.86 FAAH (0.37) FFAR4GABRA1GABRB2S1PR1PPARD
SCHEMBL1243473 0.86 FFAR4 (0.40) FFAR4CTSLCTSSCTSKGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8216489-B2 Three-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-07-10 — — US disclosed
US-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-02-17 — — US disclosed
WO-2009125668-A1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE チッソ株式会社 (JP) 2009-10-15 — — WO 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-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, L3MBTL3 FFAR4 1669/4885CTSL 2598/4885CTSS 1974/4885

“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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