SCHEMBL28219447

SCHEMBL28219447

OC1C(Cl)=C(c2ccccc2)c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.39
P2RX7 Q99572 1/20 0.35
ALDH1A1 P00352 3/20 0.34
HSD17B10 Q99714 3/20 0.34
HPGD P15428 1/20 0.34
BCL2L1 Q07817 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
FGFR1 P11362 2/20 0.34
FGFR2 P21802 2/20 0.34
FGFR4 P22455 2/20 0.34
FGFR3 P22607 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL27363609 0.78 ALDH1A1 (0.39) P2RX7ALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL28219409 0.77 ALDH1A1 (0.38) P2RX7ALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL9799817 0.71 MAOA (0.44) CYP2A6ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL29884836 0.69 MAOA (0.52) ALDH1A1HSD17B10HDAC4HDAC8HDAC6
SCHEMBL216862 0.69 MAOA (0.52) ALDH1A1HSD17B10HDAC4HDAC8HDAC6
SCHEMBL29376368 0.69 MAOA (0.52) ALDH1A1HSD17B10HDAC4HDAC8HDAC6
SCHEMBL27506926 0.69 MAOA (0.38) ALDH1A1HSD17B10HPGDKDM4EMEN1
SCHEMBL7324096 0.67 CHRNB2 (0.45) CYP2A6ALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL11356819 0.67 ALDH1A1 (0.40) P2RX7ALDH1A1HSD17B10HPGDBCL2L1
SCHEMBL27688305 0.67 MAOA (0.50) ALDH1A1HSD17B10HDAC4HDAC8HDAC6

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-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 claimed
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-108137729-A It is used to form the catalyst of multimodal polymer 埃克森美孚化学专利公司 2018-06-08 CN disclosed