SCHEMBL18323658

SCHEMBL18323658

COCc1cccc2nnc(C)n12

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
PBRM1 Q86U86 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
BRD4 O60885 15/20 0.39
POLB P06746 1/20 0.37
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 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
SCHEMBL18323661 0.80 POLB (0.47) SMN1; SMN2PBRM1L3MBTL1BRD4POLB
SCHEMBL18323677 0.80 POLB (0.57) BRD4POLBKDM4EMEN1KMT2A
SCHEMBL18323663 0.77 SMN1; SMN2 (0.42) SMN1; SMN2PBRM1L3MBTL1BRD4POLB
SCHEMBL18323632 0.76 KDM4E (0.55) SMN1; SMN2PBRM1L3MBTL1BRD4KDM4E
SCHEMBL18323671 0.75 SMN1; SMN2 (0.40) SMN1; SMN2PBRM1L3MBTL1BRD4POLB
SCHEMBL18323654 0.73 SMN1; SMN2 (0.44) SMN1; SMN2PBRM1L3MBTL1BRD4POLB
SCHEMBL11918890 0.72 SMN1; SMN2 (0.38) SMN1; SMN2PBRM1L3MBTL1BRD4POLB
SCHEMBL18323577 0.69 KDM4E (0.36) BRD4KDM4EMEN1KMT2A
SCHEMBL12510358 0.68 CHEK1 (0.60) SMN1; SMN2PBRM1L3MBTL1BRD4POLB
SCHEMBL18323608 0.68 CA12 (0.40) SMN1; SMN2L3MBTL1BRD4POLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9522910-B2 Protein kinase inhibitors (variants), use thereof in treating oncological diseases and a pharmaceutical composition based thereon Obshchestvo s ogranichennoy otvetstvennostyou “Fusion Pharma” (RU) 2016-12-20 US disclosed