SCHEMBL28256384

SCHEMBL28256384

CCCCCC1=CCC([Zr]C2=CC(CCCCC)=CC2)=C1

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.31
CYP19A1 P11511 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
ACHE P22303 1/20 0.31
BACE1 P56817 1/20 0.31
CYP3A4 P08684 1/20 0.31
PTGS2 P35354 1/20 0.31

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
Hydrochloric Acid SCHEMBL6235831 0.98 SPHK1 (0.30) SPHK1CYP19A1LIPGACHEBACE1
Hydrochloric Acid SCHEMBL28249098 0.98 SPHK1 (0.30) SPHK1CYP19A1LIPGACHEBACE1
SCHEMBL2907314 0.94 NPC1 (0.31)
SCHEMBL6250217 0.76 PTGS2 (0.36) CYP19A1LIPGACHEBACE1CYP3A4
SCHEMBL6253058 0.74 PTGS2 (0.38) CYP19A1LIPGACHEBACE1CYP3A4
SCHEMBL6250287 0.74 PTGS2 (0.38) CYP19A1LIPGACHEBACE1CYP3A4
SCHEMBL6253785 0.74 PTGS2 (0.38) CYP19A1LIPGACHEBACE1CYP3A4
SCHEMBL27446595 0.74 PTGS2 (0.35) CYP19A1LIPGACHEBACE1CYP3A4
Hydrochloric Acid SCHEMBL6674992 0.73 CYP19A1 (0.31) CYP19A1LIPGACHEBACE1CYP3A4
Hydrochloric Acid SCHEMBL8397551 0.73 PTGS2 (0.37) CYP19A1LIPGACHEBACE1CYP3A4

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
CN-108929186-A Method for preparing high viscosity index lubricating oil base oil 中国石油天然气股份有限公司 2018-12-04 CN claimed
CN-109467629-A Alumoxane catalyst activator, the Its Preparation Method And Use obtained by aluminum dialkyl cation precursor agents 格雷斯公司 2019-03-15 CN disclosed
CN-109320637-A A kind of ethylene polymerization carried metallocene catalyst and preparation method thereof 吉化集团吉林市天龙催化剂有限公司 2019-02-12 CN disclosed
CN-108929186-A Method for preparing high viscosity index lubricating oil base oil 中国石油天然气股份有限公司 2018-12-04 CN disclosed
CN-108794964-A A kind of visual inner locking type femoral interlocking nail 温州市中心医院 2018-11-13 CN disclosed