SCHEMBL7097269

SCHEMBL7097269

O=C(NCc1ccccc1)n1[c]ccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 1/20 0.48
BCHE P06276 1/20 0.47
KDM4E B2RXH2 1/20 0.46
TSHR P16473 2/20 0.45
HPGD P15428 1/20 0.45
CACNA1G O43497 1/20 0.45
CACNA1H O95180 1/20 0.45
CACNA1I Q9P0X4 1/20 0.45
GAA P10253 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ASAH1 Q13510 1/20 0.44
CASP3 P42574 1/20 0.44
RIPK1 Q13546 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
F2 P00734 1/20 0.43

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
SCHEMBL7630561 0.75 TP53 (0.45) P2RX4BCHEKDM4ETSHRGAA
SCHEMBL6151655 0.75 BCHE (0.46) BCHEKDM4EHPGDGAAMEN1
SCHEMBL11027751 0.72 ASAH1 (0.46) P2RX4BCHEKDM4ETSHRHPGD
SCHEMBL4197501 0.71 KDM4E (0.69) KDM4ETSHRMEN1KMT2ANPSR1
SCHEMBL5800630 0.71 KDM4E (0.69) KDM4ETSHRMEN1KMT2ANPSR1
SCHEMBL5217325 0.70 KDM4E (0.68) KDM4ETSHRMEN1KMT2ANPSR1
SCHEMBL6559744 0.70 KDM4E (0.68) KDM4ETSHRMEN1KMT2ANPSR1
SCHEMBL23455649 0.70 SMN1; SMN2 (0.54) P2RX4BCHEGAAASAH1
SCHEMBL714625 0.68 EPHX1 (0.77) KDM4ETSHRHPGDGAAMEN1
SCHEMBL3056874 0.68 KMT2A (0.71) KDM4ETSHRHPGDGAAMEN1

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-1296975-A1 4-HETEROARYL-3-HETEROARYLIDENYL-2-INDOLINONES AND THEIR USE AS PROTEIN KINASE INHIBITORS Sugen, Inc. (US) 2003-04-02 EP disclosed
WO-2002002551-A1 4-HETEROARYL-3-HETEROARYLIDENYL-2-INDOLINONES AND THEIR USE AS PROTEIN KINASE INHIBITORS SUGEN, INC. (US) 2002-01-10 WO disclosed