SCHEMBL9968249

SCHEMBL9968249

CCC(C)(C)c1cc2c(cn1)c1ccc([Si](c3ccccc3)(c3ccccc3)c3ccc4c5cnc(C(C)(C)CC)cc5n(-c5ccccc5)c4c3)cc1n2-c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 0.35
MAPK14 Q16539 1/20 0.35
MAT2A P31153 6/20 0.33
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PRMT5 O14744 1/20 0.31
CYP1A2 P05177 1/20 0.31
CDK4 P11802 1/20 0.31
CDK6 Q00534 1/20 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
SCHEMBL9968221 0.78 KDM4E (0.36) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL25806675 0.75 L3MBTL1 (0.60) MAT2AALDH1A1KDM4EATML3MBTL1
SCHEMBL17463310 0.74 L3MBTL1 (0.58) MAT2AALDH1A1KDM4EATML3MBTL1
SCHEMBL17463300 0.72 KDM4E (0.51) MAT2AALDH1A1KDM4EATML3MBTL1
SCHEMBL26717655 0.72 L3MBTL1 (0.55) MAT2AALDH1A1KDM4EATML3MBTL1
SCHEMBL17463311 0.72 L3MBTL1 (0.55) MAT2AALDH1A1KDM4EATML3MBTL1
SCHEMBL26715693 0.72 L3MBTL1 (0.55) MAT2AALDH1A1KDM4EATML3MBTL1
SCHEMBL19870111 0.72 L3MBTL1 (0.55) MAT2AALDH1A1KDM4EATML3MBTL1
SCHEMBL26717670 0.72 L3MBTL1 (0.55) MAT2AALDH1A1KDM4EATML3MBTL1
SCHEMBL17463298 0.71 L3MBTL1 (0.44) ALDH1A1KDM4EATML3MBTL1

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-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed
US-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed