SCHEMBL12817385

SCHEMBL12817385

COc1cc([SiH3])cc(OC)c1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.59
▸ CYP3A4 P08684 1/20 0.56
▸ MAPT P10636 1/20 0.56
▸ CA9 Q16790 1/20 0.56
▸ PTGS2 P35354 1/20 0.52
▸ HTR2A P28223 1/20 0.46
▸ HTR2C P28335 1/20 0.46
▸ HTR2B P41595 1/20 0.46
▸ CYP1A1 P04798 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP1B1 Q16678 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ TUBB4A P04350 4/20 0.43
▸ TUBB P07437 4/20 0.43
▸ TUBA3C P0DPH7 4/20 0.43
▸ TUBA1B P68363 4/20 0.43
▸ TUBA4A P68366 4/20 0.43

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
SCHEMBL721861 0.77 ACHE (0.65) ACHECYP3A4MAPTCA9PTGS2
SCHEMBL171116 0.74 ACHE (1.00) ACHECYP3A4MAPTCA9PTGS2
SCHEMBL686849 0.74 CYP1A2 (0.64) ACHECYP3A4MAPTCA9PTGS2
SCHEMBL1402314 0.74 ACHE (0.62) ACHECYP3A4MAPTCA9PTGS2
SCHEMBL2097204 0.74 ACHE (0.54) ACHECYP3A4MAPTCA9PTGS2
SCHEMBL679526 0.73 ACHE (0.60) ACHECYP3A4MAPTCA9PTGS2
SCHEMBL8710437 0.72 ACHE (0.59) ACHECYP3A4MAPTCA9PTGS2
SCHEMBL7655795 0.72 ACHE (0.59) ACHECYP3A4MAPTCA9PTGS2
SCHEMBL18472614 0.72 ACHE (0.59) ACHECYP3A4MAPTCA9PTGS2
SCHEMBL429756 0.72 ACHE (0.59) ACHECYP3A4MAPTCA9PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2691405-A1 METHOD FOR PRODUCING THE TRANSITION METAL COMPLEX, CATALYST FOR TRIMERIZATION, METHOD FOR PRODUCING 1-HEXENE, METHOD FOR PRODUCING THE SUBSTITUTED CYCLOPENTADIENE COMPOUND (2) Sumitomo Chemical Company Limited (JP) 2014-02-05 — — EP disclosed
WO-2012133925-A1 METHOD FOR PRODUCING THE TRANSITION METAL COMPLEX, CATALYST FOR TRIMERIZATION, METHOD FOR PRODUCING 1-HEXENE, METHOD FOR PRODUCING THE SUBSTITUTED CYCLOPENTADIENE COMPOUND (2) SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 — — WO disclosed
US-7838131-B2 Light emitting element and azole compound FUJIFILM CORPORATION (JP) 2010-11-23 — — US disclosed
US-20100044638-A1 1,3,5-Tri((2-(methyl-)benzimidazol-1-yl)-)benzene; OLED'shaving a light emission maximum wavelength of 500 nm or less wherein the minimum excitation triplet energy level of the host material is higher than the minimum excitation triplet energy level of the light emitting material FUJIFILM CORPORATION (JP) 2010-02-25 — — US disclosed
US-7632579-B2 Light emitting element and azole compound FUJIFILM CORPORATION (JP) 2009-12-15 — — US disclosed
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