SCHEMBL13137333

SCHEMBL13137333

c1ccc(-c2ccc(C3(c4ccccc4)c4cc(N(c5ccccc5)c5ccc6ccccc6c5)ccc4-c4ccc(N(c5ccccc5)c5ccc6ccccc6c5)cc43)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 3/20 0.32
▸ ALOX5 P09917 3/20 0.32
▸ ESR1 P03372 2/20 0.31
▸ ESR2 Q92731 2/20 0.31
▸ GSTP1 P09211 1/20 0.31
▸ PDK2 Q15119 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.30
▸ MAPT P10636 2/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ OPRK1 P41145 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ TDP1 Q9NUW8 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
SCHEMBL17243473 0.94 ESR1 (0.36) PTGESALOX5ESR1ESR2GSTP1
SCHEMBL17243470 0.94 ESR1 (0.36) PTGESALOX5ESR1ESR2GSTP1
SCHEMBL17461753 0.93 ALDH1A1 (0.34) PDK2KDM4EMAPTMEN1LMNA
SCHEMBL13137302 0.93 ALDH1A1 (0.34) PDK2KDM4EMAPTMEN1LMNA
SCHEMBL13137313 0.93 L3MBTL1 (0.37) PTGESALOX5PDK2KDM4EMAPT
SCHEMBL26478146 0.93 ESR1 (0.31) PTGESALOX5ESR1ESR2PDK2
SCHEMBL17970835 0.92 MEN1 (0.36) PTGESALOX5ESR1ESR2GSTP1
SCHEMBL10034357 0.92 ESR1 (0.37) PTGESALOX5ESR1ESR2GSTP1
SCHEMBL17690872 0.92 MEN1 (0.36) PTGESALOX5ESR1ESR2GSTP1
SCHEMBL20466619 0.92 ESR1 (0.37) PTGESALOX5ESR1ESR2GSTP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799440-B2 Organic electroluminescent device and host material of luminescent and hole-blocking material thereof CHI MEI OPTOELECTRONICS CORP. (TW) 2010-09-21 — — US disclosed
US-7799440-B2 Organic electroluminescent device and host material of luminescent and hole-blocking material thereof CHI MEI OPTOELECTRONICS CORP. (TW) 2010-09-21 — — US disclosed
US-20070015005-A1 Organic electroluminescent device and host material of luminescent and hole-blocking material thereof CHI MEI OPTOELECTRONICS CORP. (TW) 2007-01-18 — — US disclosed
US-20070015005-A1 Organic electroluminescent device and host material of luminescent and hole-blocking material thereof CHI MEI OPTOELECTRONICS CORP. (TW) 2007-01-18 — — US disclosed
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