SCHEMBL15908010

SCHEMBL15908010

CC1(C)c2cc(-c3c4ccccc4c(-c4ccc(-c5cccs5)c5ccccc45)c4ccccc34)ccc2-c2cc3c4ccccc4c4ccccc4c3cc21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.40
▸ PGR P06401 1/20 0.32
▸ ALK Q9UM73 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ BTK Q06187 1/20 0.32
▸ ALOX5 P09917 1/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ LPL P06858 1/20 0.31
▸ LIPG Q9Y5X9 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ACHE P22303 1/20 0.30
▸ ADORA1 P30542 1/20 0.30
▸ GLO1 Q04760 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
SCHEMBL15908015 0.88 PDK2 (0.44) PDK2PGRALKKCNH2ALOX5
SCHEMBL10153460 0.86 PDK2 (0.46) PDK2PGRALKKCNH2ALOX5
SCHEMBL15908008 0.81 HTR1B (0.33) PDK2
SCHEMBL19564781 0.78 — —
SCHEMBL15908016 0.78 BRD4 (0.33) PDK2
SCHEMBL19569658 0.77 ALOX5 (0.44) ALOX5MEN1KMT2A
SCHEMBL4234951 0.76 PDK2 (0.35) PDK2KCNH2
SCHEMBL10014418 0.76 PDK2 (0.57) PDK2PGRKCNH2ALOX5PTGS1
SCHEMBL19564778 0.76 GPR3 (0.35) ALKALOX5
SCHEMBL19564779 0.74 ALOX5 (0.43) ALKKCNH2ALOX5

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-9048437-B2 Organic compound for organic electroluminescent device NINGBO LUMILAN ADVANCED MATERIALS CO., LTD. (CN) 2015-06-02 — — US disclosed
US-9048437-B2 Organic compound for organic electroluminescent device NINGBO LUMILAN ADVANCED MATERIALS CO., LTD. (CN) 2015-06-02 — — US disclosed
US-20140209866-A1 ORGANIC COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2014-07-31 — — US disclosed
US-20140209866-A1 ORGANIC COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2014-07-31 — — US disclosed
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