SCHEMBL2728075

SCHEMBL2728075

COc1cc(OC)cc(C(/C(=C(\C#N)c2c[nH]c3ccccc23)c2ccc(Cl)cc2)=C(/C#N)c2c[nH]c3ccccc23)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF20A O95235 3/20 0.56
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
NPC1 O15118 2/20 0.49
SMN1; SMN2 Q16637 4/20 0.48
TP53 P04637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TUBB1 Q9H4B7 1/20 0.42
IGF1R P08069 2/20 0.42
MET P08581 2/20 0.42
IDO1 P14902 2/20 0.41
MAPT P10636 4/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
NR4A2 P43354 1/20 0.40
CREBBP Q92793 1/20 0.40
GABRP O00591 2/20 0.39

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
SCHEMBL2725902 0.87 KIF20A (0.58) KIF20AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL2726053 0.77 MEN1 (0.46) KIF20AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL2725962 0.77 KIF20A (0.56) KIF20AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL2727891 0.75 MEN1 (0.48) KIF20AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL2725570 0.74 KIF20A (0.43) KIF20AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL2727478 0.74 KIF20A (0.44) KIF20AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL2724561 0.72 KIF20A (1.00) KIF20AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL2724567 0.72 KIF20A (1.00) KIF20AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL2726433 0.72 KIF20A (0.59) KIF20AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL2724741 0.72 GABRP (0.48) KIF20AMEN1KMT2ANPC1SMN1; SMN2

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 4 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
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