SCHEMBL28025451

SCHEMBL28025451

Cc1cc2c(cc1C)C(c1ccccc1)=C[CH]2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.36
CYP2A6 P11509 1/20 0.34
CYP2B6 P20813 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
NQO2 P16083 1/20 0.33
ERBB2 P04626 1/20 0.33
RAB9A P51151 3/20 0.33
NPC1 O15118 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
PDGFRB P09619 1/20 0.33
KDR P35968 1/20 0.33
FLT3 P36888 1/20 0.33
BACE1 P56817 1/20 0.31
ALDH1A1 P00352 5/20 0.31
KDM4E B2RXH2 3/20 0.31
POLB P06746 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
SCHEMBL28302275 0.98 ESR2 (0.35) ESR2CYP2A6CYP2B6L3MBTL1MEN1
SCHEMBL28510021 0.78 PTGS2 (0.37) ESR2CYP2A6L3MBTL1MEN1KMT2A
SCHEMBL5076754 0.73 ALDH1A1 (0.41) CYP2A6BACE1ALDH1A1MAPK1MAOB
SCHEMBL28506923 0.72 MAP2K4 (0.34) CYP2A6LMNAALDH1A1KDM4EMAPT
SCHEMBL28512147 0.72 CYP1A2 (0.40) CYP2A6MEN1KMT2ALMNARAB9A
SCHEMBL28303649 0.71 ALDH1A1 (0.39) CYP2A6BACE1ALDH1A1MAPK1MAOB
SCHEMBL28517482 0.70 HTR7 (0.39) L3MBTL1MEN1KMT2ALMNAGAA
SCHEMBL27503901 0.70 PSMB5 (0.36) ESR2CYP2A6L3MBTL1MEN1KMT2A
SCHEMBL28025999 0.69 MEN1 (0.33) MEN1KMT2ALMNANQO2SMN1; SMN2
SCHEMBL28025933 0.69 FABP4 (0.35) MEN1KMT2ALMNARAB9ANPC1

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-108137729-B Catalysts for forming multimodal polymers 埃克森美孚化学专利公司 2021-02-05 CN disclosed
CN-109824802-A Metallocenic compound, catalyst system and the polymerization using them of bridging 埃克森美孚化学专利公司 2019-05-31 CN disclosed
CN-104822697-A Bridged metallocene compounds, catalyst systems and polymerization processes using the same EXXONMOBIL CHEM PATENTS INC 2015-08-05 CN disclosed