SCHEMBL20506407

SCHEMBL20506407

CC(C)(O)c1c(F)cccc1Oc1cnc2ccc(F)cc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PDGFRB P09619 2/20 0.36
▸ PDGFRA P16234 2/20 0.36
▸ TNF P01375 5/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ F2 P00734 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ PPARG P37231 4/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CASP3 P42574 1/20 0.33
▸ SENP8 Q96LD8 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33
▸ SENP6 Q9GZR1 1/20 0.33
▸ EGLN1 Q9GZT9 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33

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
SCHEMBL12487949 0.83 EGLN1 (0.34) TNFPPARGEGLN1
SCHEMBL12489724 0.80 EGLN1 (0.37) MAOBL3MBTL1TNFPPARGEGLN1
SCHEMBL30451840 0.80 EGLN1 (0.33) TNFEGLN1
SCHEMBL17144997 0.80 TSHR (0.41) MAOBPDGFRBPDGFRATNFALDH1A1
SCHEMBL20577271 0.79 GCK (0.36) TNFALDH1A1EGLN1
SCHEMBL23747866 0.79 L3MBTL1 (0.37) L3MBTL1PDGFRBPDGFRAALDH1A1F2
SCHEMBL23747871 0.79 L3MBTL1 (0.37) L3MBTL1PDGFRBPDGFRAALDH1A1F2
SCHEMBL29138802 0.77 KDM4E (0.37) MAOBPPARGCYP3A4EGLN1HTR2C
SCHEMBL23747861 0.74 MAPT (0.42) L3MBTL1ALDH1A1HPGDPPARGCYP3A4
SCHEMBL12489581 0.74 EGLN1 (0.35) PPARGCYP3A4EGLN1

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-2522658-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND AGRICULTURAL/HORTICULTURAL GERMICIDE NIPPON SODA CO (JP) 2018-09-26 — — EP claimed
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