SCHEMBL667872

SCHEMBL667872

O=C(O)c1ccc(OC(=O)c2ccc(O)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.64
CA2 P00918 3/20 0.64
CA12 O43570 2/20 0.64
CA7 P43166 2/20 0.64
CA9 Q16790 2/20 0.64
CA14 Q9ULX7 2/20 0.64
CA3 P07451 1/20 0.64
TYR P14679 1/20 0.64
DRD1 P21728 1/20 0.64
CA4 P22748 1/20 0.64
CA6 P23280 1/20 0.64
CA5A P35218 1/20 0.64
CA5B Q9Y2D0 1/20 0.64
SRD5A2 P31213 1/20 0.57
PARP10 Q53GL7 1/20 0.55
HSD17B10 Q99714 2/20 0.52
SENP1 Q9P0U3 1/20 0.50
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
F2 P00734 1/20 0.49

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
SCHEMBL8422974 1.00 CA1 (0.64) CA1CA2CA12CA7CA9
SCHEMBL5016587 1.00 CA1 (0.64) CA1CA2CA12CA7CA9
Paraben SCHEMBL5083082 1.00 CA1 (0.64) CA1CA2CA12CA7CA9
SCHEMBL20500513 1.00 CA1 (0.64) CA1CA2CA12CA7CA9
SCHEMBL17734117 1.00 CA1 (0.64) CA1CA2CA12CA7CA9
SCHEMBL27763413 0.98 CA1 (0.61) CA1CA2CA12CA7CA9
SCHEMBL10493933 0.94 HSD17B10 (0.61) CA1CA2CA12CA7CA9
SCHEMBL5015778 0.94 HSD17B10 (0.61) CA1CA2CA12CA7CA9
Paraben SCHEMBL5083113 0.94 HSD17B10 (0.61) CA1CA2CA12CA7CA9
SCHEMBL11024128 0.94 CA1 (0.57) CA1CA2CA12CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060282914-A1 Targeted dna insertion in plants BASF AGRICULTURAL SOLUTIONS US LLC 2006-12-14 US claimed
JP-60156646-A None JP disclosed
US-20190214145-A1 Method and systems for creating and screening patient metabolite profile to diagnose current medical condition, diagnose current treatment state and recommend new treatment regimen KUREK ITZHAK (US) 2019-07-11 US disclosed
EP-2986688-B1 MESOGENIC COMPOUND, LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2017-04-19 EP disclosed
CN-102617736-B The stable interferon alpha polyoxyethylene glycol conjugate represented by a kind of positional isomers CLOSED JOINT STOCK COMPANY BIOCAD (RU) 2015-11-25 CN disclosed
US-20150049291-A1 OPTICAL FILM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-02-19 US disclosed
CN-101442956-B Catheter lock solution comprising citrate and paraben ASH ACCESS TECHNOLOGY INC 2014-05-07 CN disclosed
US-8546299-B2 Color-developing composition and recording material containing the same NIPPON SODA CO., LTD. (JP) 2013-10-01 US disclosed
CN-103037858-A Composition for prevention and treatment of contact lens papillary conjunctivitis and allergic eye disease HOLDEN BRIEN VISION INST 2013-04-10 CN disclosed
CN-102617736-A The new stable polyethylene glycol conjugate of interferon alpha, represented by one positional isomer BIOCAD CJSC 2012-08-01 CN disclosed
US-5352379-A Mixture of antiferroelectric liquid crystal and cholesteric liquid crystal MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-10-04 US disclosed
EP-0296571-B1 Method of producing a liquid crystal optical element IDEMITSU KOSAN CO (JP) 1994-03-30 EP disclosed
CN-1083112-A A kind of method for determining bacteria and equipment HE LIN (CN) 1994-03-02 CN disclosed
EP-0521617-A1 Liquid crystal composition, liquid crystal element and process for the preparation of liquid crystal element MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-01-07 EP disclosed
EP-0354355-A1 Optically active compound and liquid crystal composition MITSUBISHI RAYON CO., LTD. (JP) 1990-02-14 EP disclosed
EP-0297554-A2 Liquid-crystalline polymer composition IDEMITSU KOSAN COMPANY LIMITED (JP) 1989-01-04 EP disclosed
JP-S60156646-A P-HYDROXYBENZOIC ACID COMPOUND YOSHITOMI PHARMACEUT IND LTD 1985-08-16 JP disclosed
WO-1985003289-A1 PARAHYDROXYBENZOATE COMPOUND YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1985-08-01 WO disclosed
US-4485029-A ANTISEPTICS, CONTACT LENSES, PRESERVATION, CLEANING, GLYCERYL LAURATE, P-HYDROXYBENZOIC ACID ESTER MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-11-27 US disclosed
US-3953491-A ELECTROOPTICS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DT) 1976-04-27 US disclosed