SCHEMBL28570731

SCHEMBL28570731

CC(C)CC(Cc1ccccc1)(C(=O)OC1CCCCC1)C(=O)OC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.41
CHRM3 P20309 4/20 0.39
LMNA P02545 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP1A2 P05177 1/20 0.39
SCN1A P35498 1/20 0.39
SCN2A Q99250 1/20 0.39
SCN3A Q9NY46 1/20 0.39
FABP7 O15540 1/20 0.39
FABP5 Q01469 1/20 0.39
CHRM2 P08172 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL28559393 0.88 CYP19A1 (0.44) CYP19A1CHRM3FABP7FABP5
SCHEMBL28651221 0.88 CYP19A1 (0.40) CYP19A1CHRM3LMNACYP2D6CYP1A2
SCHEMBL28647858 0.85 CHRM3 (0.46) CYP19A1CHRM3LMNACYP2D6FABP7
SCHEMBL28817699 0.84 LNPEP (0.36) CYP19A1LMNACYP2D6CYP1A2SCN1A
SCHEMBL28658742 0.83 CYP19A1 (0.42) CYP19A1CHRM3LMNACYP2D6CHRM2
SCHEMBL28656077 0.80 CYP19A1 (0.49) CYP19A1CHRM3LMNACYP2D6FABP7
SCHEMBL28650587 0.79 CYP19A1 (0.49) CYP19A1CHRM3LMNACYP2D6CHRM2
SCHEMBL181269 0.76 CHRM3 (0.45) CYP19A1CHRM3LMNACYP2D6CHRM2
SCHEMBL28003828 0.76 LNPEP (0.37) CYP19A1CHRM3LMNACYP2D6CYP1A2
SCHEMBL28559325 0.75 TAAR1 (0.44) CYP19A1CHRM3LMNACYP2D6CYP1A2

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-109678996-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-11-19 CN disclosed
CN-109678997-B Catalyst component and catalyst for olefin polymerization, prepolymerized catalyst and olefin polymerization method 中国石油化工股份有限公司 2021-11-19 CN disclosed
CN-109678998-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-11-19 CN disclosed
CN-109679006-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-08-03 CN disclosed
CN-109679004-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-05-11 CN disclosed