SCHEMBL3915104

SCHEMBL3915104

COC(=O)c1c(OC)ccc2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 2/20 0.70
MAPT P10636 2/20 0.55
MTNR1A P48039 2/20 0.51
MTNR1B P49286 2/20 0.51
KDM4E B2RXH2 2/20 0.51
HPGD P15428 2/20 0.51
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.51
PKM P14618 1/20 0.51
HTT P42858 1/20 0.51
BLM P54132 1/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CNR2 P34972 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48

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
SCHEMBL10617741 0.90 NCEH1 (0.57) NCEH1MAPTMTNR1AMTNR1BKDM4E
SCHEMBL23499947 0.86 CNR2 (0.59) NCEH1MAPTMTNR1AMTNR1BKDM4E
SCHEMBL5068205 0.85 NCEH1 (0.54) NCEH1MAPTKDM4EHPGDMEN1
SCHEMBL3357585 0.84 NCEH1 (0.65) NCEH1MAPTMTNR1AMTNR1BKDM4E
SCHEMBL979842 0.84 CA12 (0.58) NCEH1MAPTMTNR1AMTNR1BKDM4E
SCHEMBL30676839 0.84 NCEH1 (0.65) NCEH1MAPTMTNR1AMTNR1BKDM4E
SCHEMBL17502589 0.84 NCEH1 (0.63) NCEH1KDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL17502669 0.84 KDM4E (0.53) NCEH1MAPTKDM4EHPGDMEN1
SCHEMBL4006154 0.84 NCEH1 (0.52) NCEH1MAPTMTNR1AMTNR1BKDM4E
SCHEMBL11841026 0.83 MMP3 (0.55) NCEH1MAPTMTNR1AMTNR1BKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9738736-B2 Combined internal donor system for Ziegler-Natta polyolefin catalysts and methods of making and using same W. R. GRACE & CO.-CONN (US) 2017-08-22 US claimed
WO-2016025194-A1 COMBINED INTERNAL DONOR SYSTEM FOR ZIEGLER-NATTA POLYOLEFIN CATALYSTS AND METHODS OF MAKING AND USING SAME BASF CORPORATION (US) 2016-02-18 WO claimed
US-20160046740-A1 COMBINED INTERNAL DONOR SYSTEM FOR ZIEGLER-NATTA POLYOLEFIN CATALYSTS AND METHODS OF MAKING AND USING SAME W. R. GRACE & CO.-CONN. 2016-02-18 US claimed
WO-2016022421-A1 SOLID CATALYST COMPONENTS FOR OLEFIN POLYMERIZATION AND METHODS OF MAKING AND USING THE SAME BASF CORPORATION (US) 2016-02-11 WO claimed
JP-7069993-A None JP disclosed
CN-103534205-B Graphene, the facile syntheesis of Graphene derivative and abrasive material nano particle and their various uses include using as beneficial lubricant additive in tribology 绝世环球有限责任公司 2018-12-28 CN disclosed
US-9932238-B2 Graphene and graphene oxide nano-environments for chemical reactions and atomic reformations PEERLESS WORLDWIDE, LLC (US) 2018-04-03 US disclosed
US-9738736-B2 Combined internal donor system for Ziegler-Natta polyolefin catalysts and methods of making and using same W. R. GRACE & CO.-CONN (US) 2017-08-22 US disclosed
US-9663595-B2 Solid catalyst components for olefin polymerization and methods of making and using the same W. R. Grace & Co. —Conn. (US) 2017-05-30 US disclosed
WO-2016025194-A1 COMBINED INTERNAL DONOR SYSTEM FOR ZIEGLER-NATTA POLYOLEFIN CATALYSTS AND METHODS OF MAKING AND USING SAME BASF CORPORATION (US) 2016-02-18 WO disclosed
US-20160046740-A1 COMBINED INTERNAL DONOR SYSTEM FOR ZIEGLER-NATTA POLYOLEFIN CATALYSTS AND METHODS OF MAKING AND USING SAME W. R. GRACE & CO.-CONN. 2016-02-18 US disclosed
WO-2016022421-A1 SOLID CATALYST COMPONENTS FOR OLEFIN POLYMERIZATION AND METHODS OF MAKING AND USING THE SAME BASF CORPORATION (US) 2016-02-11 WO disclosed
US-5994270-A CONTROLLING GAEUMANNOMYCES MONSANTO COMPANY (US) 1999-11-30 US disclosed
CN-1217317-A Fungicidal 2-methoxybenzophenones AMERICAN CYANAMID CO (US) 1999-05-26 CN disclosed
EP-0619297-B1 Fungicides for the control of take-all desease of plants MONSANTO CO (US) 1997-06-18 EP disclosed
JP-H0769993-A PRODUCTION OF METHYL 5-BROMO-6-METHOXY-1-NAPHTOATE CASSELLA AG 1995-03-14 JP disclosed
EP-0619297-A1 Fungicides for the control of take-all desease of plants MONSANTO COMPANY (US) 1994-10-12 EP disclosed
US-4590290-A REACTING DIMETHYL SULFATE WITH G-HYDROXY-1-NAPHTHOIC ACID AMERICAN CYANAMID COMPANY (US) 1986-05-20 US disclosed
US-4137272-A Process for the manufacture of 2-alkoxy-6-bromo-naphthalenes HOECHST AKTIENGESELLSCHAFT (DE) 1979-01-30 US disclosed
US-4052438-A ESTERIFICATION, DIALKYL SULFATE HOECHST AKTIENGESELLSCHAFT (DT) 1977-10-04 US disclosed