SCHEMBL9330728

SCHEMBL9330728

O=C(OCc1ccccc1)Oc1cc[c]cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
HTT P42858 1/20 0.54
GFER P55789 1/20 0.54
HSD17B10 Q99714 1/20 0.54
ALDH1A1 P00352 4/20 0.49
TDP1 Q9NUW8 2/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
LMNA P02545 2/20 0.44
HCAR2 Q8TDS4 1/20 0.44
FABP7 O15540 1/20 0.42
FABP5 Q01469 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
HTR2A P28223 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL6611364 0.93 KMT2A (0.50) KMT2AMEN1HTTGFERHSD17B10
SCHEMBL697595 0.88 KMT2A (0.60) KMT2AMEN1HTTGFERHSD17B10
SCHEMBL1927968 0.83 LMNA (0.59) KMT2AMEN1HTTGFERHSD17B10
SCHEMBL10490891 0.83 KMT2A (0.50) KMT2AMEN1HTTGFERHSD17B10
SCHEMBL10596156 0.81 KMT2A (0.55) KMT2AMEN1HTTGFERHSD17B10
SCHEMBL9328838 0.80 KMT2A (0.65) KMT2AMEN1HTTGFERHSD17B10
SCHEMBL17473134 0.80 KMT2A (0.54) KMT2AMEN1HTTGFERHSD17B10
SCHEMBL5654161 0.80 RAB9A (0.56) KMT2AMEN1HTTGFERHSD17B10
SCHEMBL9573616 0.80 ALDH1A1 (0.62) KMT2AMEN1HTTGFERHSD17B10
SCHEMBL8942876 0.80 TDP1 (0.44) KMT2AMEN1HSD17B10ALDH1A1TDP1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5294737-A Hydrolysis, cyclization, condensation THE RESEARCH FOUNDATION STATE UNIVERSITY OF NEW YORK (US) 1994-03-15 US claimed
US-4684641-A BACTERICIDES PFIZER INC. (US) 1987-08-04 US claimed
EP-0219926-A2 Cephalosporins, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1987-04-29 EP claimed
EP-0168177-A2 Cephalosporin antibiotics Pfizer Limited (GB) 1986-01-15 EP claimed
US-4430344-A Antihypertensive 4-thiazolidinecarboxylic acids SANTEN PHARMACEUTICAL CO., LTD. (JP) 1984-02-07 US claimed
US-4347371-A HYPERTENSIVE AGENTS; ANTIDIABETIC AGENTS; VISION DEFECTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1982-08-31 US claimed
EP-0031104-A1 Thiazolidine compounds, processes for their preparation and pharmaceutical compositions containing them SANTEN PHARMACEUTICAL CO., LTD. (JP) 1981-07-01 EP claimed
US-4181800-A ANTIBIOTICS FROM SUBSTITUTED PERHYDRO-S-TRIAZINES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-01-01 US claimed
US-5359017-A Using an organoiron compound NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1994-10-25 US disclosed
EP-0511405-A1 CATIONICALLY POLYMERIZABLE ORGANIC MATERIAL COMPOSITION AND STABILIZATION OF SAID COMPOSITION NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1992-11-04 EP disclosed
US-4835150-A ANTIBIOTICS BEECHAM GROUP P.L.C. (GB) 1989-05-30 US disclosed
EP-0308559-A2 Cephalosporins, process for their preparation, pharmaceutical compositions containing them and intermediates BEECHAM GROUP PLC (GB) 1989-03-29 EP disclosed
EP-0265185-A2 Cephalosporins, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1988-04-27 EP disclosed
US-4684641-A BACTERICIDES PFIZER INC. (US) 1987-08-04 US disclosed
US-4410542-A HYPOTENSIVE AGENTS, PYRROLINE-1,2-DICARBOXYLIC ACID DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1983-10-18 US disclosed
EP-0067612-A1 Penicillin derivatives BEECHAM GROUP PLC (GB) 1982-12-22 EP disclosed
US-4347371-A HYPERTENSIVE AGENTS; ANTIDIABETIC AGENTS; VISION DEFECTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1982-08-31 US disclosed
US-4288364-A REACTING A 3-/2-HYDROXYIMINOACETYLAMINO/-2-OXOAZETIDINE WITH AN ORGANIC CARBONATE OR ACYL HALIDE CIBA-GEIGY CORPORATION (US) 1981-09-08 US disclosed
US-4203982-A Arylmalonamidomethoxycephalosporins SHIONOGI & CO., LTD. (JP) 1980-05-20 US disclosed
EP-0005507-A1 Process for the fragmentation of 3-(2-hydroxyimino-acetylamino)-2-oxo azetidin compounds and compounds obtained thereby CIBA-GEIGY AG (CH) 1979-11-28 EP disclosed