SCHEMBL16549082

SCHEMBL16549082

N#Cc1ccc2c(c1)c1cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)ccc1n2-c1ccc2ccccc2c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 2/20 0.39
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ PDPK1 O15530 1/20 0.36
▸ STK10 O94804 1/20 0.35
▸ SLK Q9H2G2 1/20 0.35
▸ KDM1A O60341 1/20 0.34
▸ PDE9A O76083 1/20 0.34
▸ TDP2 O95551 4/20 0.33
▸ MCL1 Q07820 1/20 0.33
▸ PTGER4 P35408 1/20 0.32
▸ ENPP3 O14638 1/20 0.32

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
SCHEMBL16548991 0.92 CA1 (0.38) PIM1CA1CA2PDPK1STK10
SCHEMBL16548994 0.91 CA1 (0.37) PIM1CA1CA2PDPK1STK10
SCHEMBL16548680 0.91 CA1 (0.40) CA1CA2PDPK1PDE9ATDP2
SCHEMBL19155644 0.90 XDH (0.39) PIM1CA1CA2PDPK1KDM1A
SCHEMBL16549078 0.90 CA1 (0.38) PIM1CA1CA2PDPK1STK10
SCHEMBL15158509 0.90 CA1 (0.38) PIM1CA1CA2PDPK1STK10
SCHEMBL16557943 0.89 PIM1 (0.40) PIM1CA1CA2PDPK1STK10
SCHEMBL16548670 0.88 CA1 (0.38) CA1CA2PDPK1PDE9ATDP2
SCHEMBL13351730 0.88 CA1 (0.40) CA1CA2PDPK1STK10SLK
SCHEMBL15449933 0.87 KDM4E (0.36) PIM1

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-9716234-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-25 — — US disclosed
US-20150060787-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-05 — — US disclosed
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