SCHEMBL18323632

SCHEMBL18323632

COCc1cc(C)cc2nnc(C)n12

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
DNMT1 P26358 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PBRM1 Q86U86 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
BRD4 O60885 3/20 0.31

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
SCHEMBL18323657 0.80 KDM4E (0.60) KDM4EDNMT1SMN1; SMN2PBRM1L3MBTL1
SCHEMBL18323577 0.79 KDM4E (0.36) KDM4EBRD4
SCHEMBL18323675 0.77 BRD4 (0.39) KDM4EBRD4
SCHEMBL18323608 0.77 CA12 (0.40) KDM4ESMN1; SMN2L3MBTL1BRD4
SCHEMBL18323658 0.76 SMN1; SMN2 (0.41) KDM4ESMN1; SMN2PBRM1L3MBTL1BRD4
SCHEMBL18323652 0.73 KDM4E (0.60) KDM4EDNMT1SMN1; SMN2PBRM1L3MBTL1
SCHEMBL18323669 0.72 BRD4 (0.47) KDM4EBRD4
SCHEMBL18323646 0.71 KDM4E (1.00) KDM4EDNMT1SMN1; SMN2PBRM1L3MBTL1
SCHEMBL18323644 0.69 KDM4E (0.55) KDM4EDNMT1SMN1; SMN2PBRM1L3MBTL1
SCHEMBL18323651 0.68 KDM4E (0.64) KDM4EDNMT1SMN1; SMN2PBRM1L3MBTL1

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