SCHEMBL847204

SCHEMBL847204

C=Cc1ccccc1CN(CC(=O)O)CC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.44
▸ ALOX15 P16050 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ CYP2C19 P33261 2/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ KEAP1 Q14145 2/20 0.38
▸ AKR1B1 P15121 1/20 0.37
▸ EPOR P19235 1/20 0.36
▸ EYA2 O00167 1/20 0.35
▸ APP P05067 1/20 0.35
▸ ACE P12821 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CHRM2 P08172 1/20 0.34
▸ ADRA2A P08913 1/20 0.34
▸ DRD1 P21728 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34

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
SCHEMBL10985490 0.95 TDP1 (0.41) TDP1ALOX15TSHRCYP2C19HIF1A
SCHEMBL10984905 0.91 ALOX15 (0.38) TDP1ALOX15TSHRCYP2C19HIF1A
SCHEMBL17075274 0.88 TSHR (0.40) TDP1ALOX15TSHRCYP2C19HIF1A
SCHEMBL10985506 0.85 ALOX15 (0.36) TDP1ALOX15TSHRCYP2C19HIF1A
SCHEMBL10984140 0.83 ALOX15 (0.35) TDP1ALOX15TSHRCYP2C19HIF1A
SCHEMBL18493237 0.82 ALDH1A1 (0.44) TDP1TSHRCYP2C19ALDH1A1PTPN1
SCHEMBL641321 0.82 TDP1 (0.49) TDP1ALOX15TSHRCYP2C19HIF1A
SCHEMBL10984383 0.81 SMN1; SMN2 (0.38) ALOX15TSHRCYP2C19HIF1AALDH1A1
SCHEMBL156765 0.79 AKR1B1 (0.55) TDP1CYP2C19AKR1B1KDM4EADRA1A
SCHEMBL8907052 0.78 GAA (0.46) TDP1TSHRALDH1A1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2432588-B1 POROUS POLYMERIC SEPARATION MATERIAL BIOTAGE AB (SE) 2017-01-18 — — EP claimed
US-20120128842-A1 POROUS POLYMERIC SEPARATION MATERIAL BIOTAGE AB (SE) 2012-05-24 — — US claimed
EP-2432588-A1 POROUS POLYMERIC SEPARATION MATERIAL Biotage AB (SE) 2012-03-28 — — EP claimed
WO-2010134877-A1 POROUS POLYMERIC SEPARATION MATERIAL MIP TECHNOLOGIES AB (SE) 2010-11-25 — — WO claimed
EP-0683436-B1 Liquid toners utilizing highly fluorinated solvents MINNESOTA MINING & MFG (US) 2000-03-22 — — EP claimed
EP-0873106-A1 USE OF METALLOFLUOROCOMPLEXES FOR DENTAL COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-10-28 — — EP claimed
WO-1997018791-A1 USE OF METALLOFLUOROCOMPLEXES FOR DENTAL COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-05-29 — — WO claimed
US-5604070-A Liquid toners with hydrocarbon solvents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-02-18 — — US claimed
US-5599886-A Liquid toners with hydrocarbon solvents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-02-04 — — US claimed
US-5530053-A ELECTROSTATIC TONERS COMPRISING POLYMERIC DYES CONTAINING FLUORINATED MACROMERS COMPLEXED WITH A METAL CHARGE CONTROLLER; ANTIAGGLOMERANTS; QUICK-DRYING; TRANSFERABILITY; NON-FLAMMABLE; ELECTROGRAPHY MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-06-25 — — US claimed
US-5521271-A Liquid toners with hydrocarbon solvents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-05-28 — — US claimed
EP-0683436-A1 Liquid toners utilizing highly fluorinated solvents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-11-22 — — EP claimed
US-4133929-A Ionically modified cellulose materials for removal of heavy metal ions CIBA-GEIGY CORPORATION (US) 1979-01-09 — — US claimed
EP-2783748-B1 USE OF A SORBENT FOR EXTRACTING MYCOTOXINS BIOTAGE AB (SE) 2019-05-08 — — EP disclosed
US-10112177-B2 Material for and method of extracting mycotoxins BIOTAGE AB (SE) 2018-10-30 — — US disclosed
US-10040033-B2 Multilayer separation membrane TORAY INDUSTRIES, INC. (JP) 2018-08-07 — — US disclosed
US-4228257-A Polymers for use in image receiving elements for metallizable dyes in image transfer film units EASTMAN KODAK COMPANY (US) 1980-10-14 — — US disclosed
EP-0009411-A2 Photographic recording material containing polymers which coordinate with metal ions EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1980-04-02 — — EP disclosed
US-4193796-A CONTAINING AMIDE OR ANIONIC SULFONATE UNITA AND IMINODIACETIC ACID UNITS; USED AS OR WITH MORDANT EASTMAN KODAK COMPANY (US) 1980-03-18 — — US disclosed
US-4133929-A Ionically modified cellulose materials for removal of heavy metal ions CIBA-GEIGY CORPORATION (US) 1979-01-09 — — US disclosed
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