SCHEMBL17008455

SCHEMBL17008455

C=Cc1ccc(C(CC)(CC)P(=O)(O)O)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.42
TAS1R1 Q7RTX1 2/20 0.42
ALDH1A1 P00352 2/20 0.38
TDP1 Q9NUW8 1/20 0.35
PGK1 P00558 2/20 0.34
PGK2 P07205 2/20 0.34
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA7 P36544 1/20 0.32
CHRNA4 P43681 1/20 0.32
PTPN5 P54829 1/20 0.31
PTPN2 P17706 1/20 0.31
PTPN1 P18031 1/20 0.31
PTPN6 P29350 1/20 0.31
PTPN11 Q06124 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
NAMPT P43490 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL13281654 0.86 CYP1A2 (0.38) ALDH1A1PGK1PGK2PTPN2PTPN1
SCHEMBL13281655 0.86 CYP1A2 (0.38) ALDH1A1PGK1PGK2PTPN2PTPN1
SCHEMBL7870277 0.85 PGK1 (0.44) ALDH1A1PGK1PGK2PTPN5PTPN2
SCHEMBL9512453 0.84 EPHX2 (0.41) ALDH1A1PGK1PGK2
SCHEMBL5859053 0.80 PTPN5 (0.46) PGK1PGK2PTPN5PTPN2PTPN1
SCHEMBL2382743 0.78 TSHR (0.43) ALDH1A1PGK1PGK2PTPN5TSHR
SCHEMBL8470305 0.78 PGK1 (0.39) ALDH1A1PGK1PGK2PTPN5PTPN2
SCHEMBL10707629 0.78 ESR1 (0.46) ALDH1A1TDP1PTPN1HDAC8
SCHEMBL17311345 0.77 PGK1 (0.38) PGK1PGK2PTPN5PTPN2PTPN1
SCHEMBL1353298 0.77 PGK1 (0.47) PGK1PGK2PTPN5PTPN2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3153186-B1 METHOD FOR PRODUCING AN ANTIBACTERIAL COATING COMPOSITION FOR IMPLANTS BRASSELER GMBH & CO KG GEB (DE) 2018-03-21 EP claimed
EP-3153186-A1 METHOD FOR PRODUCING AN ANTIBACTERIAL COATING COMPOSITION FOR IMPLANTS Gebr. Brasseler GmbH & Co. KG (DE) 2017-04-12 EP claimed
EP-3105260-A1 POLYPHOSPHORUS POLYMER THAT IS THIOL-FUNCTIONALISED AT THE CHAIN ENDS AND PRODUCTION METHOD THEREOF Compagnie Générale des Etablissements Michelin (FR) 2016-12-21 EP claimed
WO-2015121225-A1 POLYMER BEARING PHOSPHORUS FUNCTIONAL GROUPS AND AT LEAST ONE AZIDE FUNCTIONAL GROUP, METHOD FOR THE SYNTHESIS THEREOF AND USE OF SAME COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2015-08-20 WO claimed
WO-2015121228-A1 PHOSPHORUS DIENE BLOCK COPOLYMER, METHOD FOR THE SYNTHESIS THEREOF AND RUBBER COMPOSITION CONTAINING SAME COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2015-08-20 WO claimed
WO-2015121223-A1 POLYPHOSPHORUS POLYMER THAT IS THIOL-FUNCTIONALISED AT THE CHAIN ENDS AND PRODUCTION METHOD THEREOF COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2015-08-20 WO claimed
CN-110869401-B Copolymer, resin composition, treating agent, and processed product 昭和电工株式会社 2022-07-12 CN disclosed
CN-110869401-A Copolymer, resin composition, treating agent, and processed product 昭和电工株式会社 2020-03-06 CN disclosed
EP-3153186-B1 METHOD FOR PRODUCING AN ANTIBACTERIAL COATING COMPOSITION FOR IMPLANTS BRASSELER GMBH & CO KG GEB (DE) 2018-03-21 EP disclosed
EP-3153186-A1 METHOD FOR PRODUCING AN ANTIBACTERIAL COATING COMPOSITION FOR IMPLANTS Gebr. Brasseler GmbH & Co. KG (DE) 2017-04-12 EP disclosed
US-20170022296-A1 METHOD FOR PRODUCING DIENE POLYMERS BEARING PHOSPHORUS FUNCTIONAL GROUPS, PRODUCTS RESULTING FROM SAID METHOD AND COMPOSITION CONTAINING SAME COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2017-01-26 US disclosed
EP-3105269-A1 METHOD FOR PRODUCING DIENE POLYMERS BEARING PHOSPHORUS FUNCTIONAL GROUPS, PRODUCTS RESULTING FROM SAID METHOD AND COMPOSITION CONTAINING SAME Compagnie Générale des Etablissements Michelin (FR) 2016-12-21 EP disclosed
WO-2015121225-A1 POLYMER BEARING PHOSPHORUS FUNCTIONAL GROUPS AND AT LEAST ONE AZIDE FUNCTIONAL GROUP, METHOD FOR THE SYNTHESIS THEREOF AND USE OF SAME COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2015-08-20 WO disclosed
WO-2015121228-A1 PHOSPHORUS DIENE BLOCK COPOLYMER, METHOD FOR THE SYNTHESIS THEREOF AND RUBBER COMPOSITION CONTAINING SAME COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2015-08-20 WO disclosed
WO-2015121224-A1 METHOD FOR PRODUCING DIENE POLYMERS BEARING PHOSPHORUS FUNCTIONAL GROUPS, PRODUCTS RESULTING FROM SAID METHOD AND COMPOSITION CONTAINING SAME COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2015-08-20 WO disclosed