SCHEMBL7843464

SCHEMBL7843464

CCOC(=O)c1csc(C=O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.47
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
CA7 P43166 3/20 0.47
CA9 Q16790 3/20 0.47
CA14 Q9ULX7 3/20 0.47
LMNA P02545 4/20 0.45
KDM4E B2RXH2 2/20 0.45
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 2/20 0.43
CYP3A4 P08684 2/20 0.42
CYP1A2 P05177 2/20 0.42
MAOA P21397 1/20 0.42
HPGD P15428 2/20 0.41
CYP2C19 P33261 2/20 0.41
HTT P42858 1/20 0.41
CYP2C9 P11712 1/20 0.41
NPC1 O15118 2/20 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
SCHEMBL2940872 0.81 ALDH1A1 (0.47) CA12CA1CA2CA7CA9
SCHEMBL31464162 0.79 DAO (0.57) CA12CA1CA2CA7CA9
SCHEMBL3659417 0.77 DAO (0.65) CA12CA1CA2CA7CA9
SCHEMBL6030268 0.77 CA12 (0.52) CA12CA1CA2CA7CA9
SCHEMBL5737532 0.76 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL8628954 0.76 DAO (0.53) CA12CA1CA2CA7CA9
SCHEMBL5025168 0.76 LMNA (0.53) CA12CA1CA2CA7CA9
SCHEMBL938203 0.76 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL3388651 0.75 CA12 (0.49) CA12CA1CA2CA7CA9
SCHEMBL5856765 0.75 CA12 (0.49) CA12CA1CA2CA7CA9

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-0934295-B1 NOVEL BI-AROMATIC DIBENZOFURAN DERIVATIVES AND THEIR USE IN HUMAN AND VETERINARY MEDICINE AND IN COSMETICS CT INTERNAT DE (FR) 2001-03-07 EP disclosed
US-6057341-A USE IN PHARMACEUTICAL COMPOSITIONS FOR HUMAN OR VETERINARY MEDICINE (SKIN, RHEUMATIC RESPIRATORY, CARDIOVASCULAR, AND OPHTHALMOLOGIC DISORDERS), OR IN COSMETIC COMPOSITIONS AS WELL CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2000-05-02 US disclosed
EP-0709382-B1 Aromatic dibenzofurane derivatives, pharmaceutical and cosmetic compositions containing them CIRD GALDERMA (FR) 1999-11-10 EP disclosed
US-5840917-A ADMINISTERING TO MAMMAL TO ERADICATE HELICOBACTER PYLORI TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-11-24 US disclosed
WO-1998042347-A1 PHARMACEUTICAL COMPOSITION CONTAINING A PHOSPHORYLAMIDE AND AN AYNTIBIOTIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-01 WO disclosed
EP-0852498-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE Takeda Chemical Industries, Ltd. (JP) 1998-07-15 EP disclosed
US-5747530-A Aromatic dibenzofuran compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-05-05 US disclosed
WO-1997011705-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-04-03 WO disclosed
EP-0709382-A1 Aromatic dibenzofurane derivatives, pharmaceutical and cosmetic compositions containing them CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1996-05-01 EP disclosed
US-5498755-A IMINE COMPOUNDS FOR SKIN DISORDERS AND ANTIINFLAMMATORY AGENTS ALLERGAN, INC. 1996-03-12 US disclosed
WO-1996006070-A1 DISUBSTITUTED ARYL AND HETEROARYL IMINES HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY ALLERGAN (US) 1996-02-29 WO disclosed