SCHEMBL10609472

SCHEMBL10609472

CCOc1cc2c(cc1OC)OC(C)(C)c1[se]nnc1-2

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ ENPP1 P22413 1/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ CTSG P08311 1/20 0.31
▸ KLK7 P49862 1/20 0.31
▸ KLK14 Q9P0G3 1/20 0.31
▸ KLK5 Q9Y337 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ CNR1 P21554 1/20 0.30
▸ CNR2 P34972 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
SCHEMBL10612536 1.00 KDM4E (0.36) KDM4ESMN1; SMN2ENPP1MAPK1CTSG
SCHEMBL10612426 0.95 — —
SCHEMBL10608680 0.91 KDM4E (0.42) KDM4E
SCHEMBL10611366 0.91 KDM4E (0.35) KDM4EENPP1CNR1CNR2
SCHEMBL10609366 0.90 KDM4E (0.34) KDM4ECNR1CNR2
SCHEMBL10609580 0.89 CNR2 (0.36) KDM4ECNR1CNR2
SCHEMBL10610467 0.88 CNR2 (0.37) KDM4ECNR1CNR2
SCHEMBL10608707 0.88 CNR2 (0.37) KDM4ECNR1CNR2
SCHEMBL10611884 0.88 CNR2 (0.37) KDM4ECNR1CNR2
SCHEMBL10609207 0.87 KDM4E (0.34) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0271550-A1 BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES AND COMPOSITIONS CONTAINING THEM ALKALOIDA VEGYéSZETI GYáR (HU) 1988-06-22 — — EP claimed
WO-1988000197-A1 BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES AND COMPOSITIONS CONTAINING THEM ALKALOIDA VEGYE^´SZETI GYA^´R (HU) 1988-01-14 — — WO claimed
EP-0271550-A1 BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES AND COMPOSITIONS CONTAINING THEM ALKALOIDA VEGYéSZETI GYáR (HU) 1988-06-22 — — EP disclosed
WO-1988000197-A1 BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES AND COMPOSITIONS CONTAINING THEM ALKALOIDA VEGYE^´SZETI GYA^´R (HU) 1988-01-14 — — WO disclosed
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