SCHEMBL9899370

SCHEMBL9899370

OCc1ccc(Cl)nc1F

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PDCD1LG2 Q9BQ51 2/20 0.31
CD274 Q9NZQ7 2/20 0.31
NOTUM Q6P988 1/20 0.31
TKT P29401 2/20 0.31
PDXK O00764 1/20 0.31
GAA P10253 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
SCHEMBL9899335 0.80 KMT2A (0.34)
SCHEMBL31361113 0.80 KMT2A (0.34)
SCHEMBL26971218 0.78
SCHEMBL30029038 0.78
SCHEMBL30968506 0.77 KDM4E (0.40) RECQLKDM4EALDH1A1NOTUMTKT
SCHEMBL29773921 0.77 KDM4E (0.31) KDM4EGAA
SCHEMBL2212306 0.77 KDM4E (0.31) KDM4EGAA
SCHEMBL844810 0.77 KDM4E (0.40) RECQLKDM4EALDH1A1NOTUMTKT
SCHEMBL9898867 0.76 AKR1B1 (0.38) KDM4EALDH1A1PDCD1LG2CD274
SCHEMBL15990329 0.76 PDXK (0.35) RECQLKDM4EALDH1A1NOTUMTKT

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
WO-2012078608-A1 PREPARATION OF PHANTASMIDINE AND ANALOGUES THEREOF BRANDEIS UNIVERSITY (US) 2012-06-14 WO disclosed
WO-2012078608-A1 PREPARATION OF PHANTASMIDINE AND ANALOGUES THEREOF BRANDEIS UNIVERSITY (US) 2012-06-14 WO disclosed