SCHEMBL347284

SCHEMBL347284

CC1=CC(C)=NCCNC(C)=CC(C)=NCCN1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 9/20 0.41
HTR1D P28221 4/20 0.36
TAAR1 Q96RJ0 3/20 0.36
HTR1B P28222 1/20 0.36
ADRA2A P08913 2/20 0.35
ADRA2B P18089 2/20 0.35
ADRA2C P18825 2/20 0.35
ADRA1D P25100 2/20 0.35
ADRA1A P35348 2/20 0.35
ADRA1B P35368 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2D6 P10635 2/20 0.35
TSHR P16473 2/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.34
THPO P40225 1/20 0.34
HIF1A Q16665 1/20 0.34
RAB9A P51151 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
SCHEMBL347283 1.00 NISCH (0.41) NISCHHTR1DTAAR1HTR1BADRA2A
SCHEMBL11883362 1.00
Perchlorate SCHEMBL6034539 0.88 NISCH (0.34) NISCHHTR1DTAAR1HTR1BADRA2A
SCHEMBL13096222 0.74 CXCR4 (0.41) NISCHHTR1DTAAR1
SCHEMBL111668 0.66
Hydrochloric Acid SCHEMBL11572539 0.64
Bromide SCHEMBL10599199 0.64
SCHEMBL11956432 0.63
SCHEMBL16900699 0.59
SCHEMBL3742115 0.58 NISCH (0.56) NISCHLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9786925-B2 Fuel cell and fuel cell use gas diffusion electrode NIPPON STEEL & SUMITOMO METAL CORPORATION (JP) 2017-10-10 US claimed
US-9786925-B2 Fuel cell and fuel cell use gas diffusion electrode NIPPON STEEL & SUMITOMO METAL CORPORATION (JP) 2017-10-10 US disclosed
EP-1748509-B1 FUEL CELL AND GAS DIFFUSION ELECTRODE FOR FUEL CELL NIPPON STEEL & SUMITOMO METAL CORP (JP) 2017-03-01 EP disclosed
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-19 US disclosed
EP-2241548-A1 Vanadium di-nuclear complex Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
EP-2241547-A1 Method for producing aromatic compound polymer Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
US-20070224479-A1 Fuel Cell and Fuel Cell Use Gas Diffusion Electrode NIPPON STEEL CORPORATION (JP) 2007-09-27 US disclosed
EP-1767560-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER Sumitomo Chemical Company, Limited (JP) 2007-03-28 EP disclosed
EP-1748509-A1 FUEL CELL AND GAS DIFFUSION ELECTRODE FOR FUEL CELL Nippon Steel Corporation (JP) 2007-01-31 EP disclosed
EP-1114836-B1 PROCESS FOR PRODUCING A RESIN COMPOSITION NAT INST OF ADVANCED IND SCIEN (JP) 2006-11-08 EP disclosed
US-6344516-B1 TRANSITION METAL COMPLEX CATALYST, OXIDATATIVE POLYMERIZATION OF PHENOL-CONTAINING VEGETABLE OIL NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2002-02-05 US disclosed
EP-1114836-A1 RESIN COMPOSITION AND PROCESS FOR PRODUCING THE SAME Japan as represented by Secretary of Agency of Industrial Science and Technology (JP) 2001-07-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER PAH, MAOA, AHR NISCH 2868/4885HTR1D 3999/4885TAAR1 2764/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.