SCHEMBL17227136

SCHEMBL17227136

COC(=O)c1ccccc1-c1cccc2c3c(oc12)C=CCC3

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ SLC6A3 Q01959 4/20 0.38
▸ SLC6A4 P31645 3/20 0.38
▸ BRAF P15056 1/20 0.38
▸ TOP2A P11388 2/20 0.37
▸ PTPRC P08575 1/20 0.36
▸ SLC6A2 P23975 1/20 0.36
▸ HTT P42858 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ MAPK10 P53779 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PTK2B Q14289 1/20 0.36
▸ NCOA1 Q15788 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ NCOA3 Q9Y6Q9 1/20 0.36
▸ PRKDC P78527 2/20 0.35

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
SCHEMBL24936790 0.84 KMT2A (0.35) KDM4EALDH1A1TOP2AHTTKMT2A
SCHEMBL22005386 0.82 ALDH1A1 (0.39) KDM4EALDH1A1SLC6A3SLC6A4BRAF
SCHEMBL10357490 0.77 LMNA (0.37) KDM4EALDH1A1PTPRCHTTKMT2A
SCHEMBL4554338 0.76 ALOX5 (0.50) KDM4EALDH1A1SLC6A3SLC6A4TOP2A
SCHEMBL23892898 0.73 — —
SCHEMBL23974745 0.73 SLC6A3 (0.38) KDM4EALDH1A1SLC6A3TOP2APTPRC
SCHEMBL18539206 0.72 SLC6A3 (0.59) KDM4EALDH1A1SLC6A3SLC6A4PTPRC
SCHEMBL19752407 0.72 ALOX5 (0.33) HTTTSHRPRKDCLMNAALOX5
SCHEMBL12698455 0.71 ALOX5 (0.42) PRKDCALOX5ATM
SCHEMBL25742319 0.71 MAOA (0.48) KDM4EALDH1A1SLC6A3SLC6A4TOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2940097-A1 ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE INCLUDING SAME Cheil Industries Inc. (KR) 2015-11-04 — — EP disclosed
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