SCHEMBL12031844

SCHEMBL12031844

c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc3cc(-c4ccc(-c5cccc6c(-c7ccc([Si](c8ccccc8)(c8ccccc8)c8ccccc8)c8ccccc78)cccc56)c5ccccc45)ccc3c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.34
MET P08581 1/20 0.34
MCL1 Q07820 1/20 0.33
ACMSD Q8TDX5 1/20 0.33
AKR1C3 P42330 4/20 0.33
AKR1C2 P52895 4/20 0.33
ESR2 Q92731 1/20 0.33
GSTP1 P09211 1/20 0.33
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
CYP2B6 P20813 1/20 0.32
CYP2C19 P33261 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
TDO2 P48775 1/20 0.32
HDAC4 P56524 1/20 0.31
HDAC2 Q92769 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
SCHEMBL12031835 0.97 GSTP1 (0.34) PIM1METAKR1C3AKR1C2ESR2
SCHEMBL13766235 0.96 GSTP1 (0.35) METAKR1C3AKR1C2ESR2GSTP1
SCHEMBL12031843 0.93 PIM1 (0.37) PIM1METMCL1ACMSDAKR1C3
SCHEMBL12031834 0.90 GSTP1 (0.39) PIM1MCL1ACMSDAKR1C3AKR1C2
SCHEMBL13766213 0.82 ENPP3 (0.32) HDAC8ENPP3ENPP1
SCHEMBL12031846 0.80 ALDH1A1 (0.33) AKR1C3AKR1C2CYP1A2KDM4EALDH1A1
SCHEMBL13162130 0.80 HDAC4 (0.39) PIM1METAKR1C3AKR1C2GSTP1
SCHEMBL13162120 0.79 HDAC4 (0.37) PIM1METMCL1ACMSDAKR1C3
SCHEMBL12031822 0.79 CYP2C9 (0.35) PIM1METMCL1ACMSDESR2
SCHEMBL12031840 0.76 KDM4E (0.30) KDM4EALDH1A1SMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9082995-B2 Organic EL element and organic EL material-containing solution IDEMITSU KOSAN CO., LTD. (JP) 2015-07-14 US disclosed
US-9082995-B2 Organic EL element and organic EL material-containing solution IDEMITSU KOSAN CO., LTD. (JP) 2015-07-14 US disclosed
US-8436343-B2 Organic EL device IDEMITSU KOSAN CO., LTD. (JP) 2013-05-07 US disclosed
US-8436343-B2 Organic EL device IDEMITSU KOSAN CO., LTD. (JP) 2013-05-07 US disclosed
US-8294142-B2 Organic EL device IDEMITSU KOSAN CO., LTD. (JP) 2012-10-23 US disclosed
US-20110309337-A1 ORGANIC EL DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2011-12-22 US disclosed
US-20100270539-A1 ORGANIC EL ELEMENT AND ORGANIC EL MATERIAL-CONTAINING SOLUTION IDEMITSU KOSAN CO., LTD. (JP) 2010-10-28 US disclosed
US-20100187517-A1 ORGANIC EL DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-07-29 US disclosed
US-20100171109-A1 ORGANIC EL DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-07-08 US disclosed
US-7666524-B2 Oligonaphthalene derivatives, and light-emitting element and light-emitting device using oligonaphthalene derivatives SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2010-02-23 US disclosed