SCHEMBL13137322

SCHEMBL13137322

c1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2cccc4ccccc24)c2cc(N(c4ccccc4)c4cccc5ccccc45)ccc2-3)c2cccc3ccccc23)cc1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 5/20 0.34
▸ KIF11 P52732 1/20 0.32
▸ PDK2 Q15119 1/20 0.32
▸ SLC6A4 P31645 1/20 0.30
▸ SLC6A3 Q01959 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
SCHEMBL29393038 0.94 SIGMAR1 (0.36) SIGMAR1PDK2
SCHEMBL13137300 0.94 SIGMAR1 (0.36) SIGMAR1PDK2
SCHEMBL13137323 0.93 SIGMAR1 (0.32) SIGMAR1SLC6A4SLC6A3
SCHEMBL15213719 0.93 KDM4E (0.35) SIGMAR1KIF11PDK2
SCHEMBL12640112 0.92 SIGMAR1 (0.35) SIGMAR1PDK2
SCHEMBL13137340 0.92 SIGMAR1 (0.33) SIGMAR1PDK2SLC6A4SLC6A3
SCHEMBL17903069 0.90 MEN1 (0.38) SIGMAR1KIF11PDK2
SCHEMBL16996117 0.90 MEN1 (0.36) SIGMAR1KIF11PDK2
SCHEMBL185011 0.90 SIGMAR1 (0.38) SIGMAR1PDK2
SCHEMBL31651411 0.90 SIGMAR1 (0.38) SIGMAR1PDK2

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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