SCHEMBL28292924

SCHEMBL28292924

Cc1ccc(-c2ccccc2)c(P(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 1/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 1/20 0.40
RECQL P46063 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
CYP3A4 P08684 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HPRT1 P00492 1/20 0.39
ESR2 Q92731 1/20 0.39
MAOB P27338 2/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
ELANE P08246 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36

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
SCHEMBL28294651 0.85 PSMB5 (0.45) PSMB5KDM4EALDH1A1MEN1KMT2A
SCHEMBL28569921 0.81 CYP3A4 (0.42) KDM4EALDH1A1MEN1KMT2ANPSR1
SCHEMBL15723539 0.80 TDP1 (0.46) KDM4EALDH1A1NPSR1LMNATDP1
SCHEMBL28905343 0.80 NPC1 (0.42) ALDH1A1KMT2AMAPTTDP1CYP3A4
SCHEMBL29669786 0.79 TDP1 (0.41) MEN1KMT2ALMNATDP1CYP3A4
SCHEMBL28133194 0.79 LMNA (0.42) PSMB5ALDH1A1LMNAMAPTTDP1
SCHEMBL12592439 0.79 TDP1 (0.44) KDM4EALDH1A1MEN1KMT2ALMNA
SCHEMBL28535167 0.78 ALDH1A1 (0.40) KDM4EALDH1A1LMNAMAPTTDP1
SCHEMBL28510500 0.78 CYP1A2 (0.40) KDM4EALDH1A1MEN1KMT2ANPSR1
SCHEMBL28530516 0.78 CYP3A4 (0.39) ALDH1A1MAPTRECQLTDP1CYP3A4

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114478627-B Allylated monophosphine ligand and preparation method thereof 湖北大学 2023-06-20 CN disclosed
CN-113666961-B Preparation method of meta-substituted biaryl tertiary phosphine ligand 湖北大学 2023-05-16 CN disclosed
CN-112876507-B Trisubstituted olefin tertiary phosphine compound and preparation method thereof 湖北大学 2022-08-30 CN disclosed
CN-114478627-A Allylation monophosphine ligand and preparation method thereof 湖北大学 2022-05-13 CN disclosed
CN-113666961-A Preparation method of meta-substituted biaryl tertiary phosphine ligand 湖北大学 2021-11-19 CN disclosed
CN-112876507-A Trisubstituted olefin tertiary phosphine compound and preparation method thereof 湖北大学 2021-06-01 CN disclosed
CN-109851635-B Novel alkylated monophosphine ligand and simple preparation method thereof 湖北大学 2021-03-16 CN disclosed
CN-112250709-A Synthesis method of ortho-aryl substituted tertiary phosphine compound 湖北大学 2021-01-22 CN disclosed
CN-109851635-A A kind of new alkylation monophosphorus ligand and its simple preparation method 湖北大学 2019-06-07 CN disclosed