SCHEMBL28015474

SCHEMBL28015474

Cc1cc2c(cc1C)CC(c1ccc(C(C)(C)C)cc1)=C2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
PTAFR P25105 3/20 0.35
KIF11 P52732 3/20 0.34
FGF23 Q9GZV9 1/20 0.34
HTR1D P28221 1/20 0.32
ADRA1A P35348 1/20 0.32
NISCH Q9Y2I1 1/20 0.32
NPC1 O15118 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
MITF O75030 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
KMT2A Q03164 1/20 0.31
RAB9A P51151 1/20 0.31
CYP11B1 P15538 2/20 0.31
CYP11B2 P19099 2/20 0.31
CYP19A1 P11511 1/20 0.31
LMNA P02545 1/20 0.31
TYR P14679 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
SCHEMBL6940199 0.85 RXRB (0.33) HTR1DKDM4EMAPT
SCHEMBL6939165 0.83 CYP11B1 (0.33) MAPTALDH1A1KMT2ACYP11B1CYP11B2
SCHEMBL6283992 0.77 CYP11B1 (0.49) TSHRPTAFRKIF11FGF23NISCH
SCHEMBL28835981 0.74 CYP11B1 (0.31) KMT2ACYP11B1CYP11B2CYP19A1
SCHEMBL6940536 0.72 CYP11B1 (0.37) KIF11KDM4EMAPTALDH1A1KMT2A
SCHEMBL6287799 0.72 TSHR (0.43) TSHRKIF11FGF23HTR1DADRA1A
SCHEMBL2627002 0.70 CYP11B1 (0.42) TSHRPTAFRKIF11FGF23HTR1D
Formaldehyde SCHEMBL27609576 0.69 TSHR (0.40) TSHRKIF11FGF23HTR1DADRA1A
SCHEMBL29873594 0.69 PTGS2 (0.44) NPC1MAPTRAB9ACYP11B1CYP11B2
SCHEMBL18328889 0.69 TDP2 (0.38) KIF11MAPTALDH1A1CYP11B1CYP11B2

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
CN-104781270-B Metallocene complexes and olefin polymerization process 日本聚丙烯株式会社 2017-10-24 CN disclosed
CN-106132975-A metallocene complex and process for producing olefin polymer 日本聚丙烯株式会社 2016-11-16 CN disclosed
CN-104781270-A Metallocene complexes and olefin polymerization process JAPAN POLYPROPYLENE CORP 2015-07-15 CN disclosed