SCHEMBL18164852

SCHEMBL18164852

O=S(=O)(Oc1cc(N(c2ccccc2)c2ccccc2)ccc1N(c1ccccc1)c1cccc(-c2cccc3c2oc2ccccc23)c1)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.39
▸ GGPS1 O95749 1/20 0.39
▸ PTGES2 Q9H7Z7 1/20 0.38
▸ CDC14B O60729 1/20 0.33
▸ CDC14A Q9UNH5 1/20 0.33
▸ PRKDC P78527 3/20 0.33
▸ PRMT5 O14744 1/20 0.31
▸ WDR77 Q9BQA1 1/20 0.31
▸ HDAC8 Q9BY41 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
SCHEMBL18164861 0.84 KMT2A (0.34) —
SCHEMBL18164868 0.83 CA12 (0.32) —
SCHEMBL16596312 0.81 ALOX5 (0.43) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL16596207 0.80 ALOX5 (0.42) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL17081283 0.79 CDC14B (0.34) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL18164807 0.79 NR1H3 (0.32) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL10110107 0.78 ALOX5 (0.57) ALOX5GGPS1PTGES2PRKDCPRMT5
SCHEMBL17705910 0.78 ALOX5 (0.57) ALOX5GGPS1PTGES2PRKDCPRMT5
SCHEMBL21515528 0.78 ALOX5 (0.57) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL18090149 0.78 ALOX5 (0.57) ALOX5GGPS1PTGES2PRKDCPRMT5

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
WO-2016167491-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC APPARATUS 덕산네오룩스 주식회사 2016-10-20 — — WO disclosed
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