SCHEMBL1200400

SCHEMBL1200400

O=[N+]([O-])c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
VCP P55072 1/20 0.40
ALDH1A1 P00352 3/20 0.36
TSHR P16473 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
CYP3A4 P08684 1/20 0.32
ATM Q13315 1/20 0.32
S100A4 P26447 1/20 0.31
GPR35 Q9HC97 1/20 0.31
HIF1A Q16665 1/20 0.31
GRIN2D O15399 3/20 0.31
GRIN3B O60391 3/20 0.31
GRIN1 Q05586 3/20 0.31
GRIN2A Q12879 3/20 0.31
GRIN2B Q13224 3/20 0.31
GRIN2C Q14957 3/20 0.31
GRIN3A Q8TCU5 3/20 0.31
HSPB1 P04792 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
SCHEMBL6232592 0.97 VCP (0.39) VCPALDH1A1TSHRTDP1CYP3A4
SCHEMBL28378850 0.97 ALDH1A1 (0.38) VCPALDH1A1TSHRTDP1CYP3A4
SCHEMBL18274954 0.93 VCP (0.40) VCPALDH1A1TSHRTDP1CYP3A4
SCHEMBL9641520 0.90 VCP (0.39) VCPALDH1A1TSHRTDP1CYP3A4
SCHEMBL5859377 0.90 ALDH1A1 (0.38) VCPALDH1A1TSHRTDP1CYP3A4
SCHEMBL27081188 0.89 ALDH1A1 (0.36) VCPALDH1A1TSHRTDP1CYP3A4
SCHEMBL27081124 0.89 ALDH1A1 (0.36) VCPALDH1A1TSHRTDP1CYP3A4
SCHEMBL25355025 0.84 S100A4 (0.38) VCPS100A4GPR35GRIN2DGRIN3B
SCHEMBL12972512 0.84 GRIN2D (0.36) VCPALDH1A1GRIN2DGRIN3BGRIN1
SCHEMBL10976267 0.84 TDP1 (0.38) VCPALDH1A1TSHRTDP1GRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117209351-A Synthesis method of hexafluorobenzene 大连奇凯医药科技有限公司 2023-12-12 CN claimed
WO-2023027630-A9 A FLOW REACTOR, METHODS OF FABRICATION AND REACTIONS THEREOF NATIONAL UNIVERSITY OF SINGAPORE (SG) 2023-07-27 WO claimed
US-20230135462-A1 CYANOACRYLATE COMPOSITIONS HENKEL AG & CO KGAA (DE) 2023-05-04 US claimed
EP-4172221-A1 CYANOACRYLATE COMPOSITIONS Henkel AG & Co. KGaA (DE) 2023-05-03 EP claimed
CN-115768845-A Cyanoacrylate compositions 汉高股份有限及两合公司 2023-03-07 CN claimed
WO-2023027630-A2 A FLOW REACTOR, METHODS OF FABRICATION AND REACTIONS THEREOF NATIONAL UNIVERSITY OF SINGAPORE (SG) 2023-03-02 WO claimed
WO-2021260160-A1 CYANOACRYLATE COMPOSITIONS Henkel IP & Holding GmbH (DE) 2021-12-30 WO claimed
CN-113707815-A Perovskite device, preparation method thereof and perovskite layer precursor liquid 深圳市华星光电半导体显示技术有限公司 2021-11-26 CN claimed
EP-3101002-A1 ARYL SULFONIC ACID COMPOUND AND USE OF SAME Nissan Chemical Industries, Ltd. (JP) 2016-12-07 EP claimed
US-8952083-B2 Fluorocopolymer composition and its production process ASAHI GLASS COMPANY, LIMITED (JP) 2015-02-10 US claimed
EP-1490454-A2 POLY(ORGANOSILOXANE) MATERIALS AND METHODS FOR HYBRID ORGANIC-INORGANIC DIELECTRICS FOR INTEGRATED CIRCUIT APPLICATIONS Silecs OY (FI) 2004-12-29 EP claimed
US-20040188713-A1 Poly(organosiloxane) materials and methods for hybrid organic-inorganic dielectrics for integrated circuit applications SILECE OY (FI) 2004-09-30 US claimed
WO-2003063205-A2 POLY(ORGANOSILOXANE) MATERIALS AND METHODS FOR HYBRID ORGANIC-INORGANIC DIELECTRICS FOR INTEGRATED CIRCUIT APPLICATIONS SILECS OY (FI) 2003-07-31 WO claimed
US-6096921-A USED FOR THE PREPARATION OF HIGH-TEMPERATURE-STABLE POLYMERS, SUCH AS POLYBENZOXAZOLES AND POLYBENZTHIAZOLES SIEMENS AKTIENGESELLSCHAFT (DE) 2000-08-01 US claimed
EP-0594317-B1 Cyanoacrylate adhesives with improved cured thermal properties utilizing substituted aromatic additive LOCTITE CORP (US) 1997-09-03 EP claimed
EP-0594317-A1 Cyanoacrylate adhesives with improved cured thermal properties utilizing substituted aromatic additive LOCTITE CORPORATION (US) 1994-04-27 EP claimed
US-5288794-A Benzene compounds substituted with two or more electron withdrawing groups and one or more leaving groups delay onset of thermal decomposition LOCTITE CORPORATION (US) 1994-02-22 US claimed
US-4606651-A Energy measuring process and apparatus COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 1986-08-19 US claimed
EP-0079282-B1 METHOD AND DEVICE FOR FAST ENERGY MEASURING, AND APPLICATION TO THE MEASURING OF THE ENERGY PRODUCED BY A PULSE LASER Commissariat à l'Energie Atomique (FR) 1986-08-13 EP claimed
EP-0079282-A1 Method and device for fast energy measuring, and application to the measuring of the energy produced by a pulse laser Commissariat à l'Energie Atomique (FR) 1983-05-18 EP claimed