SCHEMBL9202003

SCHEMBL9202003

CC(=O)Oc1cc2c(cc1OC(C)=O)CNC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.46
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
TNFSF11 O14788 1/20 0.46
ALDH1A1 P00352 3/20 0.44
TSHR P16473 3/20 0.44
GAA P10253 2/20 0.44
RAB9A P51151 1/20 0.44
ACHE P22303 1/20 0.41
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
CFD P00746 1/20 0.39
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
GLA P06280 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
ALPG P10696 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38

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
Bromide SCHEMBL9203031 0.98 KDM4E (0.45) KDM4EMAPTPOLBTNFSF11ALDH1A1
SCHEMBL9826659 0.87 PNMT (0.44) KDM4EMAPTPOLB
Bromide SCHEMBL9827389 0.86 PNMT (0.43) KDM4EMAPTPOLB
SCHEMBL9202430 0.81 MAPT (0.39) KDM4EMAPTPOLBTNFSF11ALDH1A1
SCHEMBL10798207 0.77 ACHE (0.47) KDM4EMAPTPOLBALDH1A1GAA
SCHEMBL10797761 0.77 GRIN2D (0.42) KDM4EMAPTPOLBTNFSF11ALDH1A1
SCHEMBL16715040 0.77 PGR (0.49) KDM4EMAPTPOLBTNFSF11ALDH1A1
SCHEMBL6275593 0.77 TNFSF11 (0.67) KDM4EMAPTTNFSF11ALDH1A1TSHR
Bromide SCHEMBL9204144 0.76 ACHE (0.46) KDM4EMAPTPOLBALDH1A1GAA
Hydrochloric Acid SCHEMBL27919833 0.76 ACHE (0.46) KDM4EMAPTPOLBALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0186187-B1 CEPHALOSPORIN DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1992-02-26 EP claimed
EP-0186187-A2 Cephalosporin derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1986-07-02 EP claimed
EP-0452987-B1 Isoindoline derivatives BANYU PHARMA CO LTD (JP) 1995-03-01 EP disclosed
EP-0186187-B1 CEPHALOSPORIN DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1992-02-26 EP disclosed
EP-0452987-A1 Isoindoline derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1991-10-23 EP disclosed
US-4987235-A Isoindoline derivatives and processes for their preparation BANYU PHARMACEUTICAL CO., LTD. (JP) 1991-01-22 US disclosed
US-4958029-A Process for the production of isoindoline derivatives, novel intermediates and process for their production BANYU PHARMACEUTICAL CO., LTD. (JP) 1990-09-18 US disclosed
EP-0275064-A2 Process for the production of isoindoline derivatives, novel intermediates and process for their production Banyu Pharmaceutical Co., Ltd. (JP) 1988-07-20 EP disclosed
EP-0227986-A1 Isoindoline derivatives and processes for their preparation BANYU PHARMACEUTICAL CO., LTD. (JP) 1987-07-08 EP disclosed
US-4677100-A ANTIBIOTICS BANYU PHARMACEUTICAL CO., LTD. (JP) 1987-06-30 US disclosed
EP-0186187-A2 Cephalosporin derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1986-07-02 EP disclosed