SCHEMBL17849625

SCHEMBL17849625

N#Cc1ccc(N(c2ccc(C#N)cc2)c2ccc(-c3cc4c5c(ccc6cccc(c65)C4(c4ccccc4)c4ccc5oc6ccccc6c5c4)c3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.33
PGR P06401 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL15316854 0.92 KDM4E (0.33) TNKSKDM4EALDH1A1
SCHEMBL17849663 0.82
SCHEMBL18969066 0.80 AHR (0.32) KDM4EALDH1A1
SCHEMBL18969051 0.78 MMP12 (0.32) KDM4EALDH1A1
SCHEMBL18969078 0.78 AHR (0.31) KDM4EALDH1A1
SCHEMBL18969060 0.77 MMP12 (0.31)
SCHEMBL9917252 0.77 PDK2 (0.39) TNKSPGR
SCHEMBL9917233 0.77 PDK2 (0.37) TNKSPGRKDM4EALDH1A1
SCHEMBL18969064 0.77 AHR (0.34) KDM4EALDH1A1
SCHEMBL16631097 0.76 KMT2A (0.32) PGRKDM4EALDH1A1

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-9371270-B2 Compound for organic light-emitting device and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-21 US disclosed
US-9371270-B2 Compound for organic light-emitting device and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-21 US disclosed