SCHEMBL2725919

SCHEMBL2725919

N#C/C(=C(C(=C(/C#N)c1c[nH]c2ccc(Cl)cc12)/c1cccnc1)\c1cccnc1)c1c[nH]c2ccc(F)cc12

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 6/20 0.59
CLK1 P49759 4/20 0.59
HPGD P15428 1/20 0.45
KIF20A O95235 9/20 0.43
TDO2 P48775 2/20 0.42
F7 P08709 1/20 0.40
F3 P13726 1/20 0.40
MAPT P10636 1/20 0.39
NHERF1 O14745 1/20 0.37
SNCA P37840 1/20 0.37
NR4A2 P43354 1/20 0.37

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
SCHEMBL2727931 0.83 DYRK1A (0.54) DYRK1ACLK1HPGDKIF20ATDO2
SCHEMBL2724514 0.81 DYRK1A (0.51) DYRK1ACLK1KIF20ATDO2NR4A2
SCHEMBL2726861 0.78 KIF20A (0.54) DYRK1ACLK1KIF20A
SCHEMBL2726532 0.78 KIF20A (0.54) DYRK1ACLK1KIF20A
SCHEMBL19178547 0.77 DYRK1A (0.47) DYRK1ACLK1KIF20ANR4A2
SCHEMBL2726951 0.75 DYRK1A (0.50) DYRK1ACLK1KIF20ANR4A2
SCHEMBL2726290 0.75 DYRK1A (1.00) DYRK1ACLK1KIF20ATDO2MAPT
SCHEMBL2726292 0.75 DYRK1A (1.00) DYRK1ACLK1KIF20ATDO2MAPT
SCHEMBL2726304 0.75 DYRK1A (1.00) DYRK1ACLK1KIF20ATDO2MAPT
SCHEMBL2726307 0.75 DYRK1A (1.00) DYRK1ACLK1KIF20ATDO2MAPT

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
EP-2445497-B1 Use of derivatives of indoles for the treatment of cancer CENTRE NAT DE LA RECH SCIENT (C N R S ) (FR) 2017-08-02 EP claimed
CN-102481285-A Use of derivatives of indole for the treatment of cancer CENTRE NAT RECH SCIENT 2012-05-30 CN claimed
EP-2445497-A2 USE OF DERIVATIVES OF INDOLES FOR THE TREATMENT OF CANCER Centre National de la Recherche Scientifique (FR) 2012-05-02 EP claimed
WO-2010150211-A2 USE OF DERIVATIVES OF INDOLES FOR THE TREATMENT OF CANCER CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-12-29 WO claimed
EP-2266562-A1 Use of derivatives of indoles for the treatment of cancer Centre National de la Recherche Scientifique (FR) 2010-12-29 EP claimed
CN-109863144-B Novel indole derivatives for the treatment of endometriosis 生物控制术公司 2021-12-28 CN disclosed
CN-102481285-A Use of derivatives of indole for the treatment of cancer CENTRE NAT RECH SCIENT 2012-05-30 CN disclosed
EP-2445497-A2 USE OF DERIVATIVES OF INDOLES FOR THE TREATMENT OF CANCER Centre National de la Recherche Scientifique (FR) 2012-05-02 EP disclosed
WO-2010150211-A2 USE OF DERIVATIVES OF INDOLES FOR THE TREATMENT OF CANCER CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-12-29 WO disclosed