SCHEMBL7758792

SCHEMBL7758792

CCCCCCCCCOc1ccc2c(c1)oc(=O)c1cc(OCCCCCCCCC)ccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.60
ALDH1A1 P00352 6/20 0.60
MAPT P10636 4/20 0.60
RAB9A P51151 3/20 0.60
NPC1 O15118 2/20 0.60
POLB P06746 1/20 0.60
STAT1 P42224 1/20 0.60
MAOB P27338 2/20 0.55
MAOA P21397 1/20 0.55
ACHE P22303 5/20 0.55
BCHE P06276 4/20 0.55
HPGD P15428 4/20 0.54
TSHR P16473 2/20 0.54
HSD17B10 Q99714 2/20 0.54
MAPK1 P28482 1/20 0.54
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA3 P07451 1/20 0.52
CA4 P22748 1/20 0.52

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
SCHEMBL28922154 0.91 KDM4E (0.52) KDM4EALDH1A1MAPTRAB9ANPC1
SCHEMBL28627763 0.90 KDM4E (0.76) KDM4EALDH1A1MAPTRAB9ANPC1
SCHEMBL29894593 0.90 KDM4E (0.76) KDM4EALDH1A1MAPTRAB9ANPC1
SCHEMBL26768339 0.88 KDM4E (0.55) KDM4EALDH1A1MAPTRAB9ANPC1
SCHEMBL29894611 0.87 ACHE (0.67) KDM4EALDH1A1MAPTMAOBMAOA
SCHEMBL28629168 0.87 ACHE (0.67) KDM4EALDH1A1MAPTMAOBMAOA
SCHEMBL347719 0.87 CA12 (0.54) KDM4EALDH1A1MAPTMAOBMAOA
SCHEMBL26768333 0.86 KDM4E (0.54) KDM4EALDH1A1MAPTRAB9ANPC1
SCHEMBL26768331 0.86 PDE2A (0.61) KDM4EALDH1A1MAPTRAB9ANPC1
SCHEMBL805441 0.86 MAPT (0.69) KDM4EALDH1A1MAPTRAB9ANPC1

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
JP-2001026587-A DIBENZOPYRAN-6-ONE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME CHISSO CORP 2001-01-30 JP disclosed