SCHEMBL2268564

SCHEMBL2268564

Cc1cc(C(Nc2ccccc2)(Nc2ccccc2)c2cc(C)c(N)c(C)c2)cc(C)c1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 4/20 0.38
TDP1 Q9NUW8 3/20 0.38
CYP3A4 P08684 3/20 0.38
TSHR P16473 2/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 3/20 0.35
CYP2D6 P10635 2/20 0.35
MAPT P10636 4/20 0.34
MEN1 O00255 3/20 0.34
GFER P55789 3/20 0.34
KMT2A Q03164 3/20 0.34
LMNA P02545 3/20 0.34
KDM4E B2RXH2 2/20 0.34
GAA P10253 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
HPGD P15428 2/20 0.33

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
SCHEMBL6929062 0.74 ALDH1A1 (0.43) ALDH1A1TDP1CYP3A4TSHRTP53
SCHEMBL29133891 0.71 POLB (0.54) POLBALDH1A1TDP1CYP3A4TSHR
SCHEMBL22044783 0.71 POLB (0.54) POLBALDH1A1TDP1CYP3A4TSHR
SCHEMBL28877109 0.69 MAPT (0.52) ALDH1A1TDP1CYP3A4TSHRTP53
SCHEMBL11023725 0.69 POLB (0.52) POLBALDH1A1TDP1CYP3A4TSHR
SCHEMBL22044364 0.69 ESR1 (0.55) POLBALDH1A1TDP1CYP3A4TSHR
SCHEMBL807863 0.66 ALDH1A1 (0.70) POLBALDH1A1TDP1CYP3A4TSHR
SCHEMBL22554699 0.64 ALDH1A1 (0.67) POLBALDH1A1TDP1CYP3A4TSHR
SCHEMBL22554727 0.64 ALDH1A1 (0.67) POLBALDH1A1TDP1CYP3A4TSHR
SCHEMBL22051073 0.64 ESR1 (0.49) POLBALDH1A1TDP1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2513186-A1 MULTIFUNCTIONAL ADDITIVES IN ENGINEERING THERMOPLASTICS Cytec Technology Corp. (US) 2012-10-24 EP disclosed
WO-2011084583-A1 MULTIFUNCTIONAL ADDITIVES IN ENGINEERING THERMOPLASTICS CYTEC TECHNOLOGY CORP. (US) 2011-07-14 WO disclosed