SCHEMBL16488059

SCHEMBL16488059

COc1c(C)cc(C)cc1P(c1cc(C)cc(C)c1OC)c1cc(C)cc(C)c1OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.44
▸ PTPN1 P18031 2/20 0.33
▸ MAPT P10636 4/20 0.33
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ NR3C1 P04150 1/20 0.33
▸ NR3C2 P08235 1/20 0.33
▸ RAPGEF4 Q8WZA2 3/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ F2 P00734 1/20 0.31
▸ PRSS1 P07477 1/20 0.31
▸ PRSS2 P07478 1/20 0.31
▸ PRSS3 P35030 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ AR P10275 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ GABRG2 P18507 1/20 0.30
▸ GABRB3 P28472 1/20 0.30
▸ GABRA3 P34903 1/20 0.30
▸ FFAR4 Q5NUL3 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
SCHEMBL16487758 0.92 ACHE (0.39) ACHEPTPN1NR3C1NR3C2RAPGEF4
SCHEMBL25240456 0.83 ACHE (0.41) ACHEPTPN1MAPTL3MBTL1NR3C1
SCHEMBL129762 0.80 ACHE (0.57) ACHEPTPN1MAPTL3MBTL1NR3C1
SCHEMBL258715 0.73 MAPT (0.35) ACHEMAPTL3MBTL1RAPGEF4ALDH1A1
SCHEMBL258728 0.73 MAPT (0.35) ACHEMAPTL3MBTL1RAPGEF4ALDH1A1
SCHEMBL13083360 0.71 ACHE (0.48) ACHEPTPN1MAPTL3MBTL1NR3C1
SCHEMBL10196604 0.71 ACHE (0.76) ACHEPTPN1MAPTL3MBTL1LMNA
SCHEMBL11460644 0.70 RAPGEF4 (0.38) ACHEMAPTRAPGEF4ALDH1A1LMNA
SCHEMBL542689 0.70 ACHE (0.46) ACHEPTPN1MAPTL3MBTL1NR3C1
SCHEMBL17662618 0.70 ACHE (0.46) ACHEPTPN1MAPTL3MBTL1NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8957181-B2 Preparation process for cyclic conjugated polymer and polymerization catalyst for cyclic conjugated polymer SOKEN CHEMICAL & ENGINEERING CO., LTD. (JP) 2015-02-17 — — US disclosed
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