SCHEMBL10416155

SCHEMBL10416155

O=C1OC(=O)c2cc(Oc3cccc(C(F)(F)F)c3)ccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.50
▸ MAPT P10636 2/20 0.44
▸ LTA4H P09960 1/20 0.44
▸ TEAD1 P28347 1/20 0.43
▸ MAOA P21397 3/20 0.43
▸ SCN9A Q15858 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ MAOB P27338 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ ATM Q13315 1/20 0.42
▸ NR3C1 P04150 1/20 0.42
▸ PGR P06401 1/20 0.42
▸ AR P10275 1/20 0.42
▸ ESR2 Q92731 1/20 0.42
▸ TLR8 Q9NR97 1/20 0.42
▸ TLR7 Q9NYK1 1/20 0.42
▸ TTBK1 Q5TCY1 1/20 0.41
▸ MMP2 P08253 1/20 0.41
▸ MMP3 P08254 1/20 0.41

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
SCHEMBL10416153 0.88 MAOB (0.45) KIF11MAPTMAOAMAOBL3MBTL1
SCHEMBL17886096 0.85 MAOA (0.43) KIF11MAPTMAOAALDH1A1MAOB
SCHEMBL2435900 0.84 MAOA (0.53) MAPTMAOAALDH1A1MAOBPOLB
SCHEMBL42261 0.82 MAOA (0.53) MAPTMAOAALDH1A1MAOBPOLB
SCHEMBL30950420 0.82 MAOA (0.53) MAPTMAOAALDH1A1MAOBPOLB
SCHEMBL12583807 0.81 MAOA (0.45) MAPTMAOAALDH1A1MAOBPOLB
SCHEMBL15695721 0.81 MAOA (0.43) KIF11MAPTMAOAMAOBPOLB
SCHEMBL27579381 0.80 LTA4H (0.59) KIF11MAPTLTA4HTEAD1SCN9A
SCHEMBL30970619 0.80 MAOA (0.56) MAPTMAOAALDH1A1MAOBPOLB
SCHEMBL1501398 0.80 MAOA (0.56) MAPTMAOAALDH1A1MAOBPOLB

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-4960905-A CURING AGENT FOR EPOXY RESINS OCCIDENTAL CHEMICAL CORPORATION (US) 1990-10-02 — — US claimed
EP-0308863-A2 Process for the preparation of phenoxy phthalic anhydrides OCCIDENTAL CHEMICAL CORPORATION (US) 1989-03-29 — — EP claimed
EP-0308863-A2 Process for the preparation of phenoxy phthalic anhydrides OCCIDENTAL CHEMICAL CORPORATION (US) 1989-03-29 — — EP disclosed
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