SCHEMBL4073301

SCHEMBL4073301

Nc1cccc(C(O)c2cccc(N)c2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
CA9 Q16790 2/20 0.58
CYP3A4 P08684 5/20 0.55
CASP1 P29466 1/20 0.55
RECQL P46063 1/20 0.55
ALDH1A1 P00352 5/20 0.50
TDP1 Q9NUW8 2/20 0.50
CPN1 P15169 1/20 0.50
CPB2 Q96IY4 1/20 0.50
CA12 O43570 1/20 0.50
CA7 P43166 1/20 0.50
CA14 Q9ULX7 1/20 0.50
KDM4E B2RXH2 1/20 0.44
ENPP2 Q13822 1/20 0.44
MAOA P21397 1/20 0.42
TSHR P16473 2/20 0.41
HSD17B10 Q99714 1/20 0.41
F2 P00734 1/20 0.41
PLG P00747 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
SCHEMBL17064637 0.93 CA1 (0.57) CA1CA2CA9CYP3A4CASP1
SCHEMBL10953574 0.91 CA1 (0.60) CA1CA2CA9CYP3A4CASP1
SCHEMBL18623174 0.87 CA1 (0.49) CA1CA2CA9CYP3A4CASP1
SCHEMBL31067468 0.87 CA1 (0.49) CA1CA2CA9CYP3A4CASP1
SCHEMBL11783289 0.87 CA1 (0.49) CA1CA2CA9CYP3A4CASP1
SCHEMBL26185697 0.86 CYP3A4 (0.58) CA1CA2CA9CYP3A4CASP1
SCHEMBL17064649 0.85 CA1 (0.51) CA1CA2CA9CYP3A4CASP1
SCHEMBL18623097 0.85 CA1 (0.55) CA1CA2CA9CYP3A4CASP1
SCHEMBL17064379 0.85 CA1 (0.55) CA1CA2CA9CYP3A4CASP1
SCHEMBL18623178 0.85 CA1 (0.55) CA1CA2CA9CYP3A4CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4736015-A FROM DI-(ORTETRA) ESTER OF BENZHYDROL 3,3*,4,4*-TETRACARBOXYLIC ACID AND AROMATIC DIAMINE INSTITUT FRANCAIS DU PETROLE (FR) 1988-04-05 US claimed
WO-2023133943-A1 CROSS-LINKED POLYAMIC ACID ESTER AND PREPARATION METHOD THEREFOR, POLYIMIDE COMPOSITION COMPRISING SAME, AND METHOD FOR PREPARING POLYIMIDE RESIN FILM 深圳职业技术学院 2023-07-20 WO disclosed
WO-2021022224-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF THEIR USE IN THE INHIBITION OF INTERACTION BETWEEN IL18 AND IL18R BETH ISRAEL DEACONESS MEDICAL CENTER, INC. (US) 2021-02-04 WO disclosed
US-20190094694-A1 POSITIVE TYPE PHOTOSENSITIVE RESIN COMPOSITION, POSITIVE TYPE PLANOGRAPHIC PRINTING PLATE PRECURSOR, AND METHOD OF PREPARING PLANOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2019-03-28 US disclosed
US-20090281267-A1 Material for planting and use thereof KANEKA CORPORATION (JP) 2009-11-12 US disclosed
US-6596838-B1 Electrodialysis, electroosmosis, reverse osmosis COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2003-07-22 US disclosed
US-6425944-B2 DURABILITY; ELECTRIC VEHICLES; SPACECRAFT; ION EXCHANGERS; THIN FILMS COMMISSRIAT A L'ENERGIE ATOMIQUE (FR) 2002-07-30 US disclosed
US-6376129-B2 ION EXCHANGE MEMBRANE; POWER SOURCE FOR ELECTRICITY VEHICLES COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2002-04-23 US disclosed
US-20010020082-A1 Sulphonated polyimides, membranes prepared with them, and a fuel cell device that includes these membranes FAURE SYLVAIN (FR) 2001-09-06 US disclosed
US-20010019787-A1 Sulphonated polyimides, membranes prepared with them, and a fuel cell device that includes these membranes FAURE SYLVAIN (FR) 2001-09-06 US disclosed
US-6245881-B1 SULFONATED AROMATIC POLYIMIDES; DURABLE ION EXCHANGE MEMBRANES SUITABLE FOR FUEL CELLS IN ELECTRIC VEHICLES COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2001-06-12 US disclosed
US-5304627-A Polyimides containing pendent siloxane groups THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1994-04-19 US disclosed