SCHEMBL13140472

SCHEMBL13140472

C=CC1CCC(C2CCC(C(=O)Oc3cccc(F)c3)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ ELANE P08246 1/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ ABL1 P00519 1/20 0.38
▸ USP2 O75604 1/20 0.37
▸ MAPT P10636 2/20 0.36
▸ ESR1 P03372 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ PDGFRB P09619 1/20 0.36
▸ PDGFRA P16234 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KCNH2 Q12809 1/20 0.34
▸ SCN3A Q9NY46 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34

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
SCHEMBL6689211 0.85 POLB (0.58) POLBL3MBTL1ELANEKMT2AHTT
SCHEMBL11034495 0.84 POLB (0.59) POLBL3MBTL1ELANEKMT2AHTT
SCHEMBL14271074 0.84 ELANE (0.54) POLBL3MBTL1ELANEKMT2AHTT
SCHEMBL10091197 0.83 POLB (0.48) POLBL3MBTL1ELANEKMT2AHTT
SCHEMBL15224114 0.80 POLB (0.68) POLBL3MBTL1ELANEKMT2AHTT
SCHEMBL2535206 0.80 POLB (0.63) POLBL3MBTL1ELANEKMT2AHTT
SCHEMBL10091153 0.79 POLB (0.51) POLBL3MBTL1ELANEKMT2AHTT
SCHEMBL27908646 0.78 POLB (0.70) POLBL3MBTL1ELANEKMT2AHTT
SCHEMBL11035130 0.78 PTGIR (0.43) POLBL3MBTL1KMT2A
SCHEMBL11035131 0.78 PTGIR (0.43) POLBL3MBTL1KMT2A

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
EP-1897928-B1 Chlorofluorobenzene liquid crystal compound, liquid crystal composition and liquid crystal display device CHISSO CORP (JP) 2010-10-27 — — EP disclosed
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 — — WO disclosed
EP-1897928-A1 Chlorofluorobenzene liquid crystal compound, liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2008-03-12 — — EP disclosed
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