SCHEMBL18155166

SCHEMBL18155166

C[Si](C)(C)N(c1ncccn1)[Si](C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.33
HSP90AA1 P07900 1/20 0.33
KDM4E B2RXH2 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
TP53 P04637 1/20 0.31
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
POLB P06746 1/20 0.30
CCR1 P32246 1/20 0.30
CCR5 P51681 1/20 0.30
CCR8 P51685 1/20 0.30
METAP1 P53582 1/20 0.30
BLM P54132 1/20 0.30
HIF1A Q16665 1/20 0.30
DOHH Q9BU89 1/20 0.30
P4HTM Q9NXG6 1/20 0.30
SMPD3 Q9NY59 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
SCHEMBL18155167 0.77 HSP90AA1 (0.35) HSP90AA1
SCHEMBL30728657 0.71 CYP2D6 (0.48) HDAC8KDM4ETDP1LMNACYP1A2
SCHEMBL161918 0.67
SCHEMBL20188870 0.65 NOS3 (0.32) HDAC8HSP90AA1KDM4E
SCHEMBL12888687 0.65 CYP2D6 (0.34) KDM4ESMPD3
SCHEMBL30863955 0.65 HSD17B10 (0.44) HDAC8HSP90AA1KDM4ELMNACYP1A2
SCHEMBL2105061 0.63 CYP2C19 (0.33) LMNASMPD3
SCHEMBL23351695 0.62
SCHEMBL18226066 0.62
SCHEMBL30778143 0.62

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
US-9469706-B2 Polymers functionalized with unsaturated heterocycles containing a protected amino group BRIDGESTONE CORPORATION (JP) 2016-10-18 US disclosed
US-9469706-B2 Polymers functionalized with unsaturated heterocycles containing a protected amino group BRIDGESTONE CORPORATION (JP) 2016-10-18 US disclosed