SCHEMBL18323637

SCHEMBL18323637

CCc1nnc2cc(C)cc(OC)n12

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.39
DNMT1 P26358 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.33
PDE2A O00408 1/20 0.32
KMT2A Q03164 1/20 0.31
SHMT2 P34897 1/20 0.30
MAPT P10636 1/20 0.30
PDE10A Q9Y233 1/20 0.30

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
SCHEMBL18323652 0.79 KDM4E (0.60) KDM4EDNMT1SMN1; SMN2
SCHEMBL18323645 0.76 POLB (0.57) KDM4EPOLBDNMT1
SCHEMBL18323636 0.73 KDM4E (0.41) KDM4EPOLBDNMT1
SCHEMBL18323644 0.68 KDM4E (0.55) KDM4EDNMT1SMN1; SMN2KMT2AMAPT
SCHEMBL18323693 0.65 KDM4E (0.39) KDM4EPOLBSMN1; SMN2KMT2A
SCHEMBL18323657 0.65 KDM4E (0.60) KDM4EDNMT1SMN1; SMN2KMT2A
SCHEMBL11775977 0.61 KDM4E (0.56) KDM4EPOLBSMN1; SMN2KMT2AMAPT
SCHEMBL18323632 0.61 KDM4E (0.55) KDM4EDNMT1SMN1; SMN2
SCHEMBL18323677 0.59 POLB (0.57) KDM4EPOLBKMT2ASHMT2MAPT
SCHEMBL936095 0.57 POLB (0.66) KDM4EPOLBKMT2A

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